USER MOD reduce.3.24.130724 H: found=0, std=0, add=664, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 662 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 13 GLN : amide:sc= 0.82 K(o=1.1,f=-0.54) USER MOD Set 1.2: A 17 GLN : amide:sc= 0.271 X(o=1.1,f=0.89) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -100:sc= 1.28 (180deg=-0.94) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 ASN : amide:sc= -0.19 X(o=-0.19,f=-0.0017) USER MOD Single : A 6 GLN : amide:sc= -1.91 K(o=-1.9,f=-0.19) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -134:sc= 0.052 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 154:sc= 1.26 (180deg=0.848) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 ASN : amide:sc= 0.663 K(o=0.66,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -31:sc= 0.521 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0.0116 USER MOD Single : A 43 SER OG : rot -39:sc= 0.273 USER MOD Single : A 45 SER OG : rot -39:sc= 0.522 USER MOD Single : A 47 SER OG : rot 62:sc= 0.938 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 17:sc= 0.72 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 160:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A3288 GLN : amide:sc= -1.26 K(o=-1.3,f=-0.37) USER MOD Single : A3291 THR OG1 : rot 180:sc= 0 USER MOD Single : A3295 GLN : amide:sc= -0.0651 X(o=-0.065,f=0) USER MOD Single : A3299 SER OG : rot 180:sc= 0 USER MOD Single : A3301 GLN : amide:sc= -0.672 X(o=-0.67,f=-0.9) USER MOD Single : A3302 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A3306 ASN : amide:sc= 0.0244 X(o=0.024,f=-0.17) USER MOD Single : A3308 SER OG : rot 180:sc= 0 USER MOD Single : A3315 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A3317 ASN : amide:sc= -0.112 X(o=-0.11,f=-0.0037) USER MOD Single : A3320 GLN : amide:sc= -1.58 K(o=-1.6,f=-2.3) USER MOD Single : A3321 GLN : amide:sc= -0.902 K(o=-0.9,f=-0.072) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -28.434 7.771 -3.643 1.00 0.00 N ATOM 2 CA MET A 1 -27.838 8.278 -2.391 1.00 0.00 C ATOM 3 C MET A 1 -26.904 9.435 -2.738 1.00 0.00 C ATOM 4 O MET A 1 -27.129 10.102 -3.755 1.00 0.00 O ATOM 5 CB MET A 1 -27.162 7.148 -1.577 1.00 0.00 C ATOM 6 CG MET A 1 -26.319 6.174 -2.409 1.00 0.00 C ATOM 7 SD MET A 1 -27.282 5.043 -3.450 1.00 0.00 S ATOM 8 CE MET A 1 -27.542 3.674 -2.298 1.00 0.00 C ATOM 0 H1 MET A 1 -29.394 8.156 -3.751 1.00 0.00 H new ATOM 0 H2 MET A 1 -27.849 8.067 -4.451 1.00 0.00 H new ATOM 0 H3 MET A 1 -28.479 6.733 -3.610 1.00 0.00 H new ATOM 0 HA MET A 1 -28.615 8.659 -1.728 1.00 0.00 H new ATOM 0 HB2 MET A 1 -26.526 7.598 -0.815 1.00 0.00 H new ATOM 0 HB3 MET A 1 -27.934 6.584 -1.054 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.646 6.748 -3.045 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.696 5.586 -1.735 1.00 0.00 H new ATOM 0 HE1 MET A 1 -28.122 2.892 -2.788 1.00 0.00 H new ATOM 0 HE2 MET A 1 -26.578 3.271 -1.988 1.00 0.00 H new ATOM 0 HE3 MET A 1 -28.084 4.033 -1.423 1.00 0.00 H new ATOM 18 N ASN A 2 -25.934 9.760 -1.876 1.00 0.00 N ATOM 19 CA ASN A 2 -24.962 10.816 -2.126 1.00 0.00 C ATOM 20 C ASN A 2 -23.956 10.204 -3.106 1.00 0.00 C ATOM 21 O ASN A 2 -24.280 9.330 -3.919 1.00 0.00 O ATOM 22 CB ASN A 2 -24.272 11.299 -0.833 1.00 0.00 C ATOM 23 CG ASN A 2 -25.265 11.889 0.140 1.00 0.00 C ATOM 24 OD1 ASN A 2 -25.662 13.043 0.031 1.00 0.00 O ATOM 25 ND2 ASN A 2 -25.728 11.104 1.091 1.00 0.00 N ATOM 0 H ASN A 2 -25.805 9.290 -0.980 1.00 0.00 H new ATOM 0 HA ASN A 2 -25.441 11.707 -2.532 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -23.753 10.464 -0.363 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -23.516 12.045 -1.080 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -26.425 11.455 1.748 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -25.389 10.145 1.171 1.00 0.00 H new ATOM 32 N ILE A 3 -22.734 10.704 -3.097 1.00 0.00 N ATOM 33 CA ILE A 3 -21.664 10.197 -3.935 1.00 0.00 C ATOM 34 C ILE A 3 -21.241 8.842 -3.353 1.00 0.00 C ATOM 35 O ILE A 3 -21.608 8.506 -2.222 1.00 0.00 O ATOM 36 CB ILE A 3 -20.567 11.281 -3.999 1.00 0.00 C ATOM 37 CG1 ILE A 3 -19.688 11.162 -5.254 1.00 0.00 C ATOM 38 CG2 ILE A 3 -19.732 11.348 -2.707 1.00 0.00 C ATOM 39 CD1 ILE A 3 -20.465 11.425 -6.551 1.00 0.00 C ATOM 0 H ILE A 3 -22.454 11.483 -2.501 1.00 0.00 H new ATOM 0 HA ILE A 3 -21.945 10.006 -4.971 1.00 0.00 H new ATOM 0 HB ILE A 3 -21.089 12.234 -4.082 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -18.861 11.869 -5.181 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -19.252 10.164 -5.293 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -18.975 12.126 -2.803 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -20.384 11.578 -1.864 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -19.246 10.387 -2.538 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -19.793 11.327 -7.404 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -21.275 10.702 -6.643 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -20.879 12.433 -6.529 1.00 0.00 H new ATOM 51 N ASN A 4 -20.477 8.062 -4.113 1.00 0.00 N ATOM 52 CA ASN A 4 -20.010 6.743 -3.692 1.00 0.00 C ATOM 53 C ASN A 4 -18.575 6.520 -4.155 1.00 0.00 C ATOM 54 O ASN A 4 -17.757 6.054 -3.368 1.00 0.00 O ATOM 55 CB ASN A 4 -20.978 5.650 -4.172 1.00 0.00 C ATOM 56 CG ASN A 4 -21.284 5.740 -5.658 1.00 0.00 C ATOM 57 OD1 ASN A 4 -22.197 6.453 -6.072 1.00 0.00 O ATOM 58 ND2 ASN A 4 -20.486 5.115 -6.494 1.00 0.00 N ATOM 0 H ASN A 4 -20.162 8.329 -5.046 1.00 0.00 H new ATOM 0 HA ASN A 4 -20.000 6.689 -2.603 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -20.550 4.672 -3.953 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -21.909 5.724 -3.610 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -20.620 5.218 -7.500 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -19.733 4.527 -6.137 1.00 0.00 H new ATOM 65 N GLU A 5 -18.217 6.940 -5.368 1.00 0.00 N ATOM 66 CA GLU A 5 -16.861 6.806 -5.923 1.00 0.00 C ATOM 67 C GLU A 5 -15.891 7.651 -5.100 1.00 0.00 C ATOM 68 O GLU A 5 -14.738 7.288 -4.881 1.00 0.00 O ATOM 69 CB GLU A 5 -16.866 7.279 -7.376 1.00 0.00 C ATOM 70 CG GLU A 5 -17.508 6.205 -8.261 1.00 0.00 C ATOM 71 CD GLU A 5 -18.146 6.749 -9.537 1.00 0.00 C ATOM 72 OE1 GLU A 5 -18.766 7.844 -9.504 1.00 0.00 O ATOM 73 OE2 GLU A 5 -18.114 6.025 -10.558 1.00 0.00 O ATOM 0 H GLU A 5 -18.870 7.392 -6.008 1.00 0.00 H new ATOM 0 HA GLU A 5 -16.544 5.764 -5.885 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -17.418 8.215 -7.463 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -15.847 7.478 -7.708 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -16.749 5.471 -8.531 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -18.268 5.680 -7.683 1.00 0.00 H new ATOM 80 N GLN A 6 -16.378 8.803 -4.651 1.00 0.00 N ATOM 81 CA GLN A 6 -15.618 9.725 -3.818 1.00 0.00 C ATOM 82 C GLN A 6 -15.592 9.186 -2.387 1.00 0.00 C ATOM 83 O GLN A 6 -14.676 9.499 -1.630 1.00 0.00 O ATOM 84 CB GLN A 6 -16.208 11.134 -3.895 1.00 0.00 C ATOM 85 CG GLN A 6 -15.689 11.933 -5.097 1.00 0.00 C ATOM 86 CD GLN A 6 -15.784 11.222 -6.447 1.00 0.00 C ATOM 87 OE1 GLN A 6 -14.792 10.749 -6.990 1.00 0.00 O ATOM 88 NE2 GLN A 6 -16.965 11.137 -7.030 1.00 0.00 N ATOM 0 H GLN A 6 -17.323 9.126 -4.858 1.00 0.00 H new ATOM 0 HA GLN A 6 -14.592 9.799 -4.179 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -17.294 11.065 -3.953 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -15.971 11.672 -2.977 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -16.246 12.868 -5.158 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -14.646 12.194 -4.915 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -17.788 11.532 -6.575 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -17.055 10.676 -7.936 1.00 0.00 H new ATOM 97 N THR A 7 -16.602 8.417 -1.964 1.00 0.00 N ATOM 98 CA THR A 7 -16.603 7.853 -0.620 1.00 0.00 C ATOM 99 C THR A 7 -15.466 6.845 -0.490 1.00 0.00 C ATOM 100 O THR A 7 -14.849 6.832 0.571 1.00 0.00 O ATOM 101 CB THR A 7 -17.927 7.186 -0.261 1.00 0.00 C ATOM 102 OG1 THR A 7 -18.949 8.162 -0.280 1.00 0.00 O ATOM 103 CG2 THR A 7 -17.858 6.490 1.103 1.00 0.00 C ATOM 0 H THR A 7 -17.417 8.176 -2.528 1.00 0.00 H new ATOM 0 HA THR A 7 -16.462 8.678 0.078 1.00 0.00 H new ATOM 0 HB THR A 7 -18.145 6.412 -0.997 1.00 0.00 H new ATOM 0 HG1 THR A 7 -19.805 7.743 -0.052 1.00 0.00 H new ATOM 0 HG21 THR A 7 -18.820 6.027 1.324 1.00 0.00 H new ATOM 0 HG22 THR A 7 -17.082 5.724 1.082 1.00 0.00 H new ATOM 0 HG23 THR A 7 -17.623 7.223 1.874 1.00 0.00 H new ATOM 111 N LEU A 8 -15.102 6.126 -1.562 1.00 0.00 N ATOM 112 CA LEU A 8 -14.038 5.123 -1.606 1.00 0.00 C ATOM 113 C LEU A 8 -12.777 5.764 -1.056 1.00 0.00 C ATOM 114 O LEU A 8 -11.982 5.050 -0.474 1.00 0.00 O ATOM 115 CB LEU A 8 -13.734 4.680 -3.050 1.00 0.00 C ATOM 116 CG LEU A 8 -14.930 4.260 -3.918 1.00 0.00 C ATOM 117 CD1 LEU A 8 -14.531 3.870 -5.340 1.00 0.00 C ATOM 118 CD2 LEU A 8 -15.678 3.115 -3.254 1.00 0.00 C ATOM 0 H LEU A 8 -15.567 6.237 -2.463 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.356 4.255 -1.029 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -13.221 5.499 -3.554 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -13.036 3.844 -3.008 1.00 0.00 H new ATOM 0 HG LEU A 8 -15.579 5.131 -4.002 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -15.420 3.584 -5.902 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -14.051 4.718 -5.829 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -13.837 3.030 -5.306 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -16.524 2.824 -3.876 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -15.007 2.264 -3.132 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -16.039 3.435 -2.277 1.00 0.00 H new ATOM 130 N ASP A 9 -12.594 7.083 -1.187 1.00 0.00 N ATOM 131 CA ASP A 9 -11.431 7.807 -0.689 1.00 0.00 C ATOM 132 C ASP A 9 -11.187 7.489 0.790 1.00 0.00 C ATOM 133 O ASP A 9 -10.045 7.243 1.183 1.00 0.00 O ATOM 134 CB ASP A 9 -11.656 9.312 -0.859 1.00 0.00 C ATOM 135 CG ASP A 9 -10.419 10.145 -0.521 1.00 0.00 C ATOM 136 OD1 ASP A 9 -10.583 11.346 -0.189 1.00 0.00 O ATOM 137 OD2 ASP A 9 -9.291 9.661 -0.733 1.00 0.00 O ATOM 0 H ASP A 9 -13.270 7.686 -1.655 1.00 0.00 H new ATOM 0 HA ASP A 9 -10.556 7.497 -1.260 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -11.953 9.515 -1.888 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -12.483 9.624 -0.221 1.00 0.00 H new ATOM 142 N LYS A 10 -12.237 7.451 1.628 1.00 0.00 N ATOM 143 CA LYS A 10 -12.042 7.129 3.050 1.00 0.00 C ATOM 144 C LYS A 10 -11.635 5.662 3.212 1.00 0.00 C ATOM 145 O LYS A 10 -11.054 5.293 4.235 1.00 0.00 O ATOM 146 CB LYS A 10 -13.259 7.485 3.932 1.00 0.00 C ATOM 147 CG LYS A 10 -14.406 6.470 3.855 1.00 0.00 C ATOM 148 CD LYS A 10 -15.692 6.853 4.579 1.00 0.00 C ATOM 149 CE LYS A 10 -15.512 6.894 6.091 1.00 0.00 C ATOM 150 NZ LYS A 10 -16.821 6.992 6.766 1.00 0.00 N ATOM 0 H LYS A 10 -13.203 7.634 1.355 1.00 0.00 H new ATOM 0 HA LYS A 10 -11.230 7.760 3.410 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -12.931 7.569 4.968 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -13.634 8.465 3.636 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -14.642 6.298 2.805 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -14.053 5.522 4.261 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -16.027 7.829 4.228 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -16.475 6.138 4.328 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -14.990 5.997 6.425 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -14.890 7.746 6.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -16.679 7.019 7.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -17.305 7.860 6.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -17.402 6.166 6.518 1.00 0.00 H new ATOM 164 N LEU A 11 -12.063 4.798 2.290 1.00 0.00 N ATOM 165 CA LEU A 11 -11.777 3.378 2.301 1.00 0.00 C ATOM 166 C LEU A 11 -10.337 3.119 1.855 1.00 0.00 C ATOM 167 O LEU A 11 -9.566 2.494 2.575 1.00 0.00 O ATOM 168 CB LEU A 11 -12.796 2.587 1.445 1.00 0.00 C ATOM 169 CG LEU A 11 -14.256 2.449 1.936 1.00 0.00 C ATOM 170 CD1 LEU A 11 -14.374 2.080 3.410 1.00 0.00 C ATOM 171 CD2 LEU A 11 -15.140 3.661 1.636 1.00 0.00 C ATOM 0 H LEU A 11 -12.635 5.084 1.495 1.00 0.00 H new ATOM 0 HA LEU A 11 -11.880 3.018 3.325 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -12.825 3.051 0.459 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -12.399 1.581 1.312 1.00 0.00 H new ATOM 0 HG LEU A 11 -14.633 1.615 1.344 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -15.427 2.001 3.682 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -13.881 1.124 3.586 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -13.899 2.851 4.017 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -16.146 3.480 2.014 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -14.724 4.544 2.121 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -15.181 3.824 0.559 1.00 0.00 H new ATOM 183 N ARG A 12 -9.919 3.605 0.686 1.00 0.00 N ATOM 184 CA ARG A 12 -8.569 3.383 0.164 1.00 0.00 C ATOM 185 C ARG A 12 -7.509 3.911 1.103 1.00 0.00 C ATOM 186 O ARG A 12 -6.522 3.217 1.324 1.00 0.00 O ATOM 187 CB ARG A 12 -8.410 3.939 -1.256 1.00 0.00 C ATOM 188 CG ARG A 12 -8.906 5.381 -1.381 1.00 0.00 C ATOM 189 CD ARG A 12 -8.285 6.155 -2.524 1.00 0.00 C ATOM 190 NE ARG A 12 -8.016 7.558 -2.139 1.00 0.00 N ATOM 191 CZ ARG A 12 -7.060 8.365 -2.603 1.00 0.00 C ATOM 192 NH1 ARG A 12 -6.071 7.902 -3.349 1.00 0.00 N ATOM 193 NH2 ARG A 12 -7.110 9.654 -2.295 1.00 0.00 N ATOM 0 H ARG A 12 -10.509 4.166 0.072 1.00 0.00 H new ATOM 0 HA ARG A 12 -8.423 2.305 0.100 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -7.360 3.893 -1.545 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -8.960 3.307 -1.953 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -9.988 5.371 -1.510 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -8.701 5.906 -0.448 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.355 5.675 -2.829 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -8.952 6.134 -3.386 1.00 0.00 H new ATOM 0 HE ARG A 12 -8.636 7.956 -1.434 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -6.028 6.910 -3.581 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -5.351 8.537 -3.693 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -7.869 10.010 -1.714 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.390 10.289 -2.639 1.00 0.00 H new ATOM 207 N GLN A 13 -7.710 5.080 1.704 1.00 0.00 N ATOM 208 CA GLN A 13 -6.749 5.644 2.632 1.00 0.00 C ATOM 209 C GLN A 13 -6.583 4.720 3.845 1.00 0.00 C ATOM 210 O GLN A 13 -5.500 4.656 4.418 1.00 0.00 O ATOM 211 CB GLN A 13 -7.136 7.087 2.967 1.00 0.00 C ATOM 212 CG GLN A 13 -8.426 7.250 3.769 1.00 0.00 C ATOM 213 CD GLN A 13 -8.242 7.199 5.282 1.00 0.00 C ATOM 214 OE1 GLN A 13 -7.329 7.805 5.847 1.00 0.00 O ATOM 215 NE2 GLN A 13 -9.097 6.452 5.958 1.00 0.00 N ATOM 0 H GLN A 13 -8.539 5.656 1.560 1.00 0.00 H new ATOM 0 HA GLN A 13 -5.759 5.704 2.179 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -6.320 7.543 3.527 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -7.234 7.644 2.036 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -8.886 8.202 3.504 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -9.124 6.466 3.474 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -9.844 5.961 5.467 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -9.010 6.367 6.971 1.00 0.00 H new ATOM 224 N ALA A 14 -7.631 3.996 4.252 1.00 0.00 N ATOM 225 CA ALA A 14 -7.575 3.072 5.375 1.00 0.00 C ATOM 226 C ALA A 14 -6.788 1.821 4.954 1.00 0.00 C ATOM 227 O ALA A 14 -5.913 1.346 5.679 1.00 0.00 O ATOM 228 CB ALA A 14 -9.003 2.705 5.793 1.00 0.00 C ATOM 0 H ALA A 14 -8.546 4.040 3.804 1.00 0.00 H new ATOM 0 HA ALA A 14 -7.071 3.532 6.225 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -8.969 2.013 6.634 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -9.539 3.607 6.087 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -9.517 2.234 4.956 1.00 0.00 H new ATOM 234 N VAL A 15 -7.085 1.281 3.768 1.00 0.00 N ATOM 235 CA VAL A 15 -6.413 0.092 3.244 1.00 0.00 C ATOM 236 C VAL A 15 -4.931 0.382 2.988 1.00 0.00 C ATOM 237 O VAL A 15 -4.066 -0.428 3.320 1.00 0.00 O ATOM 238 CB VAL A 15 -7.135 -0.425 1.987 1.00 0.00 C ATOM 239 CG1 VAL A 15 -6.500 -1.699 1.421 1.00 0.00 C ATOM 240 CG2 VAL A 15 -8.589 -0.745 2.307 1.00 0.00 C ATOM 0 H VAL A 15 -7.799 1.658 3.145 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.460 -0.702 3.990 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.055 0.370 1.246 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -7.050 -2.018 0.536 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.463 -1.500 1.151 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.534 -2.488 2.173 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -9.087 -1.110 1.409 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -8.631 -1.511 3.082 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -9.091 0.156 2.660 1.00 0.00 H new ATOM 250 N LEU A 16 -4.610 1.549 2.431 1.00 0.00 N ATOM 251 CA LEU A 16 -3.220 1.911 2.159 1.00 0.00 C ATOM 252 C LEU A 16 -2.438 2.004 3.473 1.00 0.00 C ATOM 253 O LEU A 16 -1.310 1.524 3.531 1.00 0.00 O ATOM 254 CB LEU A 16 -3.098 3.111 1.191 1.00 0.00 C ATOM 255 CG LEU A 16 -3.202 4.550 1.711 1.00 0.00 C ATOM 256 CD1 LEU A 16 -1.867 5.069 2.244 1.00 0.00 C ATOM 257 CD2 LEU A 16 -3.673 5.464 0.560 1.00 0.00 C ATOM 0 H LEU A 16 -5.291 2.258 2.160 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.732 1.116 1.595 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -2.135 3.021 0.688 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -3.868 2.989 0.430 1.00 0.00 H new ATOM 0 HG LEU A 16 -3.915 4.557 2.536 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.990 6.091 2.601 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -1.532 4.436 3.066 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.125 5.050 1.446 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -3.750 6.490 0.919 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -2.954 5.419 -0.258 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -4.648 5.129 0.205 1.00 0.00 H new ATOM 269 N GLN A 17 -3.055 2.497 4.559 1.00 0.00 N ATOM 270 CA GLN A 17 -2.376 2.611 5.847 1.00 0.00 C ATOM 271 C GLN A 17 -1.961 1.252 6.405 1.00 0.00 C ATOM 272 O GLN A 17 -0.791 1.104 6.778 1.00 0.00 O ATOM 273 CB GLN A 17 -3.261 3.341 6.856 1.00 0.00 C ATOM 274 CG GLN A 17 -3.204 4.849 6.635 1.00 0.00 C ATOM 275 CD GLN A 17 -4.260 5.540 7.461 1.00 0.00 C ATOM 276 OE1 GLN A 17 -4.267 5.512 8.694 1.00 0.00 O ATOM 277 NE2 GLN A 17 -5.193 6.171 6.791 1.00 0.00 N ATOM 0 H GLN A 17 -4.022 2.821 4.564 1.00 0.00 H new ATOM 0 HA GLN A 17 -1.467 3.188 5.677 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -4.290 2.994 6.762 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.936 3.105 7.869 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.217 5.226 6.905 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.353 5.074 5.579 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -5.169 6.182 5.771 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -5.943 6.651 7.289 1.00 0.00 H new ATOM 286 N LYS A 18 -2.836 0.233 6.475 1.00 0.00 N ATOM 287 CA LYS A 18 -2.383 -1.063 6.985 1.00 0.00 C ATOM 288 C LYS A 18 -1.317 -1.623 6.050 1.00 0.00 C ATOM 289 O LYS A 18 -0.320 -2.146 6.541 1.00 0.00 O ATOM 290 CB LYS A 18 -3.563 -2.025 7.175 1.00 0.00 C ATOM 291 CG LYS A 18 -4.442 -2.164 5.919 1.00 0.00 C ATOM 292 CD LYS A 18 -5.873 -2.571 6.227 1.00 0.00 C ATOM 293 CE LYS A 18 -6.054 -4.099 6.330 1.00 0.00 C ATOM 294 NZ LYS A 18 -6.571 -4.611 7.620 1.00 0.00 N ATOM 0 H LYS A 18 -3.816 0.279 6.198 1.00 0.00 H new ATOM 0 HA LYS A 18 -1.937 -0.934 7.971 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -3.181 -3.007 7.454 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.178 -1.675 8.004 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -4.449 -1.215 5.383 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -3.997 -2.903 5.253 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -6.183 -2.110 7.165 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -6.531 -2.184 5.449 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -6.732 -4.418 5.538 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -5.092 -4.572 6.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -6.004 -5.429 7.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -6.509 -3.863 8.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -7.563 -4.901 7.506 1.00 0.00 H new ATOM 308 N LYS A 19 -1.460 -1.430 4.734 1.00 0.00 N ATOM 309 CA LYS A 19 -0.519 -1.897 3.722 1.00 0.00 C ATOM 310 C LYS A 19 0.888 -1.397 4.009 1.00 0.00 C ATOM 311 O LYS A 19 1.825 -2.145 3.736 1.00 0.00 O ATOM 312 CB LYS A 19 -1.002 -1.497 2.317 1.00 0.00 C ATOM 313 CG LYS A 19 -1.626 -2.674 1.549 1.00 0.00 C ATOM 314 CD LYS A 19 -2.555 -2.150 0.448 1.00 0.00 C ATOM 315 CE LYS A 19 -3.190 -3.273 -0.372 1.00 0.00 C ATOM 316 NZ LYS A 19 -2.351 -3.782 -1.482 1.00 0.00 N ATOM 0 H LYS A 19 -2.256 -0.931 4.338 1.00 0.00 H new ATOM 0 HA LYS A 19 -0.479 -2.986 3.759 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -1.735 -0.695 2.403 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -0.162 -1.101 1.747 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -0.841 -3.290 1.111 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -2.185 -3.311 2.235 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -3.342 -1.546 0.899 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -1.991 -1.495 -0.216 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -3.427 -4.102 0.295 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -4.134 -2.915 -0.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -2.615 -4.766 -1.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -2.500 -3.194 -2.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.349 -3.744 -1.206 1.00 0.00 H new ATOM 330 N ILE A 20 1.077 -0.207 4.595 1.00 0.00 N ATOM 331 CA ILE A 20 2.412 0.297 4.906 1.00 0.00 C ATOM 332 C ILE A 20 3.102 -0.677 5.855 1.00 0.00 C ATOM 333 O ILE A 20 4.268 -1.008 5.663 1.00 0.00 O ATOM 334 CB ILE A 20 2.386 1.717 5.528 1.00 0.00 C ATOM 335 CG1 ILE A 20 1.480 2.708 4.785 1.00 0.00 C ATOM 336 CG2 ILE A 20 3.807 2.305 5.633 1.00 0.00 C ATOM 337 CD1 ILE A 20 1.731 2.757 3.283 1.00 0.00 C ATOM 0 H ILE A 20 0.319 0.421 4.861 1.00 0.00 H new ATOM 0 HA ILE A 20 2.965 0.376 3.970 1.00 0.00 H new ATOM 0 HB ILE A 20 1.962 1.581 6.523 1.00 0.00 H new ATOM 0 HG12 ILE A 20 0.439 2.438 4.962 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.627 3.704 5.202 1.00 0.00 H new ATOM 0 HG21 ILE A 20 3.757 3.301 6.073 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.422 1.661 6.262 1.00 0.00 H new ATOM 0 HG23 ILE A 20 4.249 2.369 4.639 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.055 3.478 2.824 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.762 3.057 3.096 1.00 0.00 H new ATOM 0 HD13 ILE A 20 1.556 1.771 2.852 1.00 0.00 H new ATOM 349 N LYS A 21 2.383 -1.109 6.889 1.00 0.00 N ATOM 350 CA LYS A 21 2.849 -2.039 7.910 1.00 0.00 C ATOM 351 C LYS A 21 3.042 -3.428 7.319 1.00 0.00 C ATOM 352 O LYS A 21 3.826 -4.206 7.850 1.00 0.00 O ATOM 353 CB LYS A 21 1.839 -2.159 9.069 1.00 0.00 C ATOM 354 CG LYS A 21 1.245 -0.827 9.558 1.00 0.00 C ATOM 355 CD LYS A 21 0.423 -1.007 10.843 1.00 0.00 C ATOM 356 CE LYS A 21 -0.927 -1.667 10.533 1.00 0.00 C ATOM 357 NZ LYS A 21 -1.616 -2.147 11.744 1.00 0.00 N ATOM 0 H LYS A 21 1.421 -0.807 7.043 1.00 0.00 H new ATOM 0 HA LYS A 21 3.794 -1.646 8.286 1.00 0.00 H new ATOM 0 HB2 LYS A 21 1.023 -2.809 8.753 1.00 0.00 H new ATOM 0 HB3 LYS A 21 2.330 -2.650 9.909 1.00 0.00 H new ATOM 0 HG2 LYS A 21 2.050 -0.114 9.738 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.612 -0.403 8.778 1.00 0.00 H new ATOM 0 HD2 LYS A 21 0.978 -1.619 11.554 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.260 -0.038 11.316 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -1.566 -0.952 10.015 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -0.770 -2.504 9.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -2.522 -2.584 11.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -1.021 -2.850 12.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -1.792 -1.346 12.384 1.00 0.00 H new ATOM 371 N GLU A 22 2.288 -3.775 6.277 1.00 0.00 N ATOM 372 CA GLU A 22 2.392 -5.095 5.688 1.00 0.00 C ATOM 373 C GLU A 22 3.649 -5.203 4.852 1.00 0.00 C ATOM 374 O GLU A 22 4.434 -6.115 5.096 1.00 0.00 O ATOM 375 CB GLU A 22 1.154 -5.466 4.863 1.00 0.00 C ATOM 376 CG GLU A 22 -0.104 -5.463 5.733 1.00 0.00 C ATOM 377 CD GLU A 22 -1.240 -6.277 5.105 1.00 0.00 C ATOM 378 OE1 GLU A 22 -1.996 -5.723 4.270 1.00 0.00 O ATOM 379 OE2 GLU A 22 -1.380 -7.470 5.473 1.00 0.00 O ATOM 0 H GLU A 22 1.606 -3.161 5.831 1.00 0.00 H new ATOM 0 HA GLU A 22 2.450 -5.811 6.508 1.00 0.00 H new ATOM 0 HB2 GLU A 22 1.034 -4.759 4.042 1.00 0.00 H new ATOM 0 HB3 GLU A 22 1.291 -6.452 4.418 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.134 -5.871 6.715 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.436 -4.436 5.886 1.00 0.00 H new ATOM 386 N ARG A 23 3.917 -4.257 3.948 1.00 0.00 N ATOM 387 CA ARG A 23 5.120 -4.367 3.127 1.00 0.00 C ATOM 388 C ARG A 23 6.403 -4.303 3.944 1.00 0.00 C ATOM 389 O ARG A 23 7.359 -4.988 3.601 1.00 0.00 O ATOM 390 CB ARG A 23 5.102 -3.401 1.941 1.00 0.00 C ATOM 391 CG ARG A 23 4.802 -1.922 2.235 1.00 0.00 C ATOM 392 CD ARG A 23 6.062 -1.086 2.369 1.00 0.00 C ATOM 393 NE ARG A 23 6.962 -1.234 1.206 1.00 0.00 N ATOM 394 CZ ARG A 23 8.292 -1.355 1.289 1.00 0.00 C ATOM 395 NH1 ARG A 23 8.909 -1.100 2.437 1.00 0.00 N ATOM 396 NH2 ARG A 23 8.996 -1.728 0.234 1.00 0.00 N ATOM 0 H ARG A 23 3.339 -3.435 3.771 1.00 0.00 H new ATOM 0 HA ARG A 23 5.110 -5.368 2.695 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.072 -3.456 1.448 1.00 0.00 H new ATOM 0 HB3 ARG A 23 4.361 -3.759 1.227 1.00 0.00 H new ATOM 0 HG2 ARG A 23 4.184 -1.515 1.435 1.00 0.00 H new ATOM 0 HG3 ARG A 23 4.222 -1.849 3.155 1.00 0.00 H new ATOM 0 HD2 ARG A 23 5.789 -0.037 2.482 1.00 0.00 H new ATOM 0 HD3 ARG A 23 6.593 -1.377 3.275 1.00 0.00 H new ATOM 0 HE ARG A 23 6.541 -1.245 0.277 1.00 0.00 H new ATOM 0 HH11 ARG A 23 8.369 -0.813 3.253 1.00 0.00 H new ATOM 0 HH12 ARG A 23 9.923 -1.192 2.502 1.00 0.00 H new ATOM 0 HH21 ARG A 23 8.526 -1.925 -0.649 1.00 0.00 H new ATOM 0 HH22 ARG A 23 10.010 -1.818 0.303 1.00 0.00 H new ATOM 410 N ILE A 24 6.443 -3.524 5.022 1.00 0.00 N ATOM 411 CA ILE A 24 7.638 -3.434 5.855 1.00 0.00 C ATOM 412 C ILE A 24 7.820 -4.700 6.694 1.00 0.00 C ATOM 413 O ILE A 24 8.942 -5.188 6.819 1.00 0.00 O ATOM 414 CB ILE A 24 7.591 -2.175 6.748 1.00 0.00 C ATOM 415 CG1 ILE A 24 8.869 -1.996 7.596 1.00 0.00 C ATOM 416 CG2 ILE A 24 6.339 -2.153 7.642 1.00 0.00 C ATOM 417 CD1 ILE A 24 8.728 -0.848 8.595 1.00 0.00 C ATOM 0 H ILE A 24 5.663 -2.947 5.338 1.00 0.00 H new ATOM 0 HA ILE A 24 8.502 -3.346 5.197 1.00 0.00 H new ATOM 0 HB ILE A 24 7.536 -1.327 6.065 1.00 0.00 H new ATOM 0 HG12 ILE A 24 9.083 -2.921 8.132 1.00 0.00 H new ATOM 0 HG13 ILE A 24 9.718 -1.805 6.939 1.00 0.00 H new ATOM 0 HG21 ILE A 24 6.345 -1.251 8.254 1.00 0.00 H new ATOM 0 HG22 ILE A 24 5.446 -2.162 7.017 1.00 0.00 H new ATOM 0 HG23 ILE A 24 6.338 -3.030 8.289 1.00 0.00 H new ATOM 0 HD11 ILE A 24 9.647 -0.754 9.173 1.00 0.00 H new ATOM 0 HD12 ILE A 24 8.540 0.081 8.057 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.895 -1.052 9.268 1.00 0.00 H new ATOM 429 N GLN A 25 6.742 -5.223 7.290 1.00 0.00 N ATOM 430 CA GLN A 25 6.850 -6.400 8.134 1.00 0.00 C ATOM 431 C GLN A 25 7.009 -7.698 7.343 1.00 0.00 C ATOM 432 O GLN A 25 7.873 -8.509 7.663 1.00 0.00 O ATOM 433 CB GLN A 25 5.609 -6.457 9.043 1.00 0.00 C ATOM 434 CG GLN A 25 5.750 -7.477 10.177 1.00 0.00 C ATOM 435 CD GLN A 25 4.448 -7.658 10.950 1.00 0.00 C ATOM 436 OE1 GLN A 25 3.849 -8.728 10.921 1.00 0.00 O ATOM 437 NE2 GLN A 25 3.970 -6.665 11.681 1.00 0.00 N ATOM 0 H GLN A 25 5.798 -4.848 7.200 1.00 0.00 H new ATOM 0 HA GLN A 25 7.759 -6.311 8.729 1.00 0.00 H new ATOM 0 HB2 GLN A 25 5.431 -5.470 9.469 1.00 0.00 H new ATOM 0 HB3 GLN A 25 4.735 -6.708 8.442 1.00 0.00 H new ATOM 0 HG2 GLN A 25 6.063 -8.436 9.765 1.00 0.00 H new ATOM 0 HG3 GLN A 25 6.535 -7.153 10.860 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.461 -5.772 11.711 1.00 0.00 H new ATOM 0 HE22 GLN A 25 3.110 -6.793 12.215 1.00 0.00 H new ATOM 446 N ASN A 26 6.172 -7.901 6.326 1.00 0.00 N ATOM 447 CA ASN A 26 6.181 -9.104 5.505 1.00 0.00 C ATOM 448 C ASN A 26 7.308 -9.092 4.479 1.00 0.00 C ATOM 449 O ASN A 26 8.067 -10.055 4.418 1.00 0.00 O ATOM 450 CB ASN A 26 4.833 -9.276 4.772 1.00 0.00 C ATOM 451 CG ASN A 26 3.645 -9.453 5.696 1.00 0.00 C ATOM 452 OD1 ASN A 26 3.169 -10.558 5.927 1.00 0.00 O ATOM 453 ND2 ASN A 26 3.090 -8.363 6.179 1.00 0.00 N ATOM 0 H ASN A 26 5.461 -7.224 6.048 1.00 0.00 H new ATOM 0 HA ASN A 26 6.343 -9.942 6.183 1.00 0.00 H new ATOM 0 HB2 ASN A 26 4.662 -8.405 4.140 1.00 0.00 H new ATOM 0 HB3 ASN A 26 4.898 -10.141 4.112 1.00 0.00 H new ATOM 0 HD21 ASN A 26 2.251 -8.430 6.755 1.00 0.00 H new ATOM 0 HD22 ASN A 26 3.499 -7.450 5.978 1.00 0.00 H new ATOM 460 N SER A 27 7.417 -8.011 3.696 1.00 0.00 N ATOM 461 CA SER A 27 8.405 -7.812 2.629 1.00 0.00 C ATOM 462 C SER A 27 8.481 -9.003 1.653 1.00 0.00 C ATOM 463 O SER A 27 9.524 -9.280 1.054 1.00 0.00 O ATOM 464 CB SER A 27 9.754 -7.435 3.248 1.00 0.00 C ATOM 465 OG SER A 27 10.435 -6.526 2.400 1.00 0.00 O ATOM 0 H SER A 27 6.788 -7.214 3.794 1.00 0.00 H new ATOM 0 HA SER A 27 8.082 -6.980 2.003 1.00 0.00 H new ATOM 0 HB2 SER A 27 9.601 -6.986 4.229 1.00 0.00 H new ATOM 0 HB3 SER A 27 10.359 -8.330 3.397 1.00 0.00 H new ATOM 0 HG SER A 27 11.297 -6.287 2.801 1.00 0.00 H new ATOM 471 N LEU A 28 7.356 -9.699 1.470 1.00 0.00 N ATOM 472 CA LEU A 28 7.212 -10.875 0.625 1.00 0.00 C ATOM 473 C LEU A 28 5.933 -10.812 -0.210 1.00 0.00 C ATOM 474 O LEU A 28 5.146 -9.869 -0.109 1.00 0.00 O ATOM 475 CB LEU A 28 7.289 -12.130 1.527 1.00 0.00 C ATOM 476 CG LEU A 28 6.242 -12.234 2.644 1.00 0.00 C ATOM 477 CD1 LEU A 28 4.838 -12.552 2.125 1.00 0.00 C ATOM 478 CD2 LEU A 28 6.659 -13.278 3.676 1.00 0.00 C ATOM 0 H LEU A 28 6.483 -9.441 1.931 1.00 0.00 H new ATOM 0 HA LEU A 28 8.023 -10.920 -0.102 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.201 -13.012 0.893 1.00 0.00 H new ATOM 0 HB3 LEU A 28 8.279 -12.163 1.983 1.00 0.00 H new ATOM 0 HG LEU A 28 6.197 -11.250 3.111 1.00 0.00 H new ATOM 0 HD11 LEU A 28 4.145 -12.612 2.964 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.515 -11.765 1.443 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.852 -13.506 1.597 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.904 -13.337 4.460 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.756 -14.250 3.192 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.616 -12.994 4.115 1.00 0.00 H new ATOM 490 N SER A 29 5.713 -11.883 -0.963 1.00 0.00 N ATOM 491 CA SER A 29 4.616 -12.145 -1.878 1.00 0.00 C ATOM 492 C SER A 29 4.052 -13.561 -1.724 1.00 0.00 C ATOM 493 O SER A 29 2.836 -13.756 -1.764 1.00 0.00 O ATOM 494 CB SER A 29 5.215 -12.053 -3.277 1.00 0.00 C ATOM 495 OG SER A 29 5.720 -10.761 -3.558 1.00 0.00 O ATOM 0 H SER A 29 6.366 -12.666 -0.944 1.00 0.00 H new ATOM 0 HA SER A 29 3.809 -11.438 -1.685 1.00 0.00 H new ATOM 0 HB2 SER A 29 6.017 -12.784 -3.376 1.00 0.00 H new ATOM 0 HB3 SER A 29 4.455 -12.312 -4.014 1.00 0.00 H new ATOM 0 HG SER A 29 6.096 -10.746 -4.463 1.00 0.00 H new ATOM 501 N THR A 30 4.929 -14.547 -1.532 1.00 0.00 N ATOM 502 CA THR A 30 4.587 -15.957 -1.385 1.00 0.00 C ATOM 503 C THR A 30 5.589 -16.651 -0.445 1.00 0.00 C ATOM 504 O THR A 30 5.648 -17.877 -0.393 1.00 0.00 O ATOM 505 CB THR A 30 4.483 -16.577 -2.803 1.00 0.00 C ATOM 506 OG1 THR A 30 4.235 -17.970 -2.828 1.00 0.00 O ATOM 507 CG2 THR A 30 5.738 -16.332 -3.652 1.00 0.00 C ATOM 0 H THR A 30 5.933 -14.376 -1.473 1.00 0.00 H new ATOM 0 HA THR A 30 3.618 -16.095 -0.906 1.00 0.00 H new ATOM 0 HB THR A 30 3.619 -16.060 -3.221 1.00 0.00 H new ATOM 0 HG1 THR A 30 4.638 -18.388 -2.039 1.00 0.00 H new ATOM 0 HG21 THR A 30 5.608 -16.788 -4.633 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.895 -15.260 -3.768 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.603 -16.774 -3.158 1.00 0.00 H new ATOM 515 N GLU A 31 6.390 -15.898 0.317 1.00 0.00 N ATOM 516 CA GLU A 31 7.388 -16.446 1.240 1.00 0.00 C ATOM 517 C GLU A 31 8.529 -17.088 0.427 1.00 0.00 C ATOM 518 O GLU A 31 8.887 -18.252 0.603 1.00 0.00 O ATOM 519 CB GLU A 31 6.757 -17.359 2.326 1.00 0.00 C ATOM 520 CG GLU A 31 5.469 -16.793 2.970 1.00 0.00 C ATOM 521 CD GLU A 31 4.634 -17.838 3.712 1.00 0.00 C ATOM 522 OE1 GLU A 31 4.271 -17.609 4.888 1.00 0.00 O ATOM 523 OE2 GLU A 31 4.234 -18.856 3.105 1.00 0.00 O ATOM 0 H GLU A 31 6.362 -14.878 0.309 1.00 0.00 H new ATOM 0 HA GLU A 31 7.831 -15.640 1.825 1.00 0.00 H new ATOM 0 HB2 GLU A 31 6.530 -18.328 1.881 1.00 0.00 H new ATOM 0 HB3 GLU A 31 7.494 -17.533 3.110 1.00 0.00 H new ATOM 0 HG2 GLU A 31 5.741 -16.000 3.666 1.00 0.00 H new ATOM 0 HG3 GLU A 31 4.856 -16.338 2.192 1.00 0.00 H new ATOM 530 N LYS A 32 9.022 -16.352 -0.576 1.00 0.00 N ATOM 531 CA LYS A 32 10.133 -16.736 -1.452 1.00 0.00 C ATOM 532 C LYS A 32 11.424 -16.631 -0.626 1.00 0.00 C ATOM 533 O LYS A 32 11.446 -15.930 0.391 1.00 0.00 O ATOM 534 CB LYS A 32 10.185 -15.750 -2.643 1.00 0.00 C ATOM 535 CG LYS A 32 10.522 -16.333 -4.021 1.00 0.00 C ATOM 536 CD LYS A 32 9.280 -16.878 -4.751 1.00 0.00 C ATOM 537 CE LYS A 32 8.673 -18.132 -4.109 1.00 0.00 C ATOM 538 NZ LYS A 32 9.531 -19.324 -4.253 1.00 0.00 N ATOM 0 H LYS A 32 8.641 -15.435 -0.808 1.00 0.00 H new ATOM 0 HA LYS A 32 10.011 -17.749 -1.835 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.217 -15.254 -2.714 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.921 -14.980 -2.412 1.00 0.00 H new ATOM 0 HG2 LYS A 32 10.990 -15.562 -4.633 1.00 0.00 H new ATOM 0 HG3 LYS A 32 11.252 -17.134 -3.904 1.00 0.00 H new ATOM 0 HD2 LYS A 32 8.520 -16.097 -4.785 1.00 0.00 H new ATOM 0 HD3 LYS A 32 9.549 -17.106 -5.782 1.00 0.00 H new ATOM 0 HE2 LYS A 32 8.497 -17.943 -3.050 1.00 0.00 H new ATOM 0 HE3 LYS A 32 7.702 -18.332 -4.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 9.071 -20.140 -3.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 9.679 -19.525 -5.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 10.449 -19.148 -3.797 1.00 0.00 H new ATOM 552 N TYR A 33 12.525 -17.235 -1.069 1.00 0.00 N ATOM 553 CA TYR A 33 13.796 -17.182 -0.347 1.00 0.00 C ATOM 554 C TYR A 33 14.949 -17.026 -1.325 1.00 0.00 C ATOM 555 O TYR A 33 14.844 -17.477 -2.470 1.00 0.00 O ATOM 556 CB TYR A 33 14.006 -18.490 0.424 1.00 0.00 C ATOM 557 CG TYR A 33 12.868 -18.917 1.322 1.00 0.00 C ATOM 558 CD1 TYR A 33 12.754 -18.375 2.613 1.00 0.00 C ATOM 559 CD2 TYR A 33 11.942 -19.880 0.876 1.00 0.00 C ATOM 560 CE1 TYR A 33 11.719 -18.802 3.458 1.00 0.00 C ATOM 561 CE2 TYR A 33 10.909 -20.316 1.722 1.00 0.00 C ATOM 562 CZ TYR A 33 10.785 -19.762 3.014 1.00 0.00 C ATOM 563 OH TYR A 33 9.783 -20.157 3.840 1.00 0.00 O ATOM 0 H TYR A 33 12.562 -17.773 -1.935 1.00 0.00 H new ATOM 0 HA TYR A 33 13.767 -16.334 0.337 1.00 0.00 H new ATOM 0 HB2 TYR A 33 14.194 -19.287 -0.295 1.00 0.00 H new ATOM 0 HB3 TYR A 33 14.905 -18.390 1.032 1.00 0.00 H new ATOM 0 HD1 TYR A 33 13.460 -17.632 2.954 1.00 0.00 H new ATOM 0 HD2 TYR A 33 12.027 -20.285 -0.122 1.00 0.00 H new ATOM 0 HE1 TYR A 33 11.636 -18.394 4.454 1.00 0.00 H new ATOM 0 HE2 TYR A 33 10.214 -21.071 1.386 1.00 0.00 H new ATOM 0 HH TYR A 33 9.226 -20.822 3.384 1.00 0.00 H new ATOM 573 N GLY A 34 16.081 -16.491 -0.863 1.00 0.00 N ATOM 574 CA GLY A 34 17.268 -16.300 -1.681 1.00 0.00 C ATOM 575 C GLY A 34 17.805 -14.889 -1.528 1.00 0.00 C ATOM 576 O GLY A 34 17.520 -14.035 -2.370 1.00 0.00 O ATOM 0 H GLY A 34 16.195 -16.177 0.101 1.00 0.00 H new ATOM 0 HA2 GLY A 34 18.034 -17.019 -1.392 1.00 0.00 H new ATOM 0 HA3 GLY A 34 17.029 -16.492 -2.727 1.00 0.00 H new ATOM 580 N SER A 35 18.565 -14.647 -0.461 1.00 0.00 N ATOM 581 CA SER A 35 19.175 -13.364 -0.147 1.00 0.00 C ATOM 582 C SER A 35 20.675 -13.552 0.079 1.00 0.00 C ATOM 583 O SER A 35 21.123 -14.626 0.492 1.00 0.00 O ATOM 584 CB SER A 35 18.448 -12.777 1.070 1.00 0.00 C ATOM 585 OG SER A 35 19.122 -11.680 1.655 1.00 0.00 O ATOM 0 H SER A 35 18.778 -15.366 0.230 1.00 0.00 H new ATOM 0 HA SER A 35 19.075 -12.657 -0.971 1.00 0.00 H new ATOM 0 HB2 SER A 35 17.449 -12.461 0.769 1.00 0.00 H new ATOM 0 HB3 SER A 35 18.323 -13.558 1.820 1.00 0.00 H new ATOM 0 HG SER A 35 18.608 -11.352 2.422 1.00 0.00 H new ATOM 591 N GLY A 36 21.423 -12.468 -0.122 1.00 0.00 N ATOM 592 CA GLY A 36 22.864 -12.393 0.026 1.00 0.00 C ATOM 593 C GLY A 36 23.553 -12.726 -1.293 1.00 0.00 C ATOM 594 O GLY A 36 22.986 -13.405 -2.150 1.00 0.00 O ATOM 0 H GLY A 36 21.014 -11.578 -0.406 1.00 0.00 H new ATOM 0 HA2 GLY A 36 23.151 -11.393 0.351 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.193 -13.086 0.800 1.00 0.00 H new ATOM 598 N SER A 37 24.782 -12.252 -1.464 1.00 0.00 N ATOM 599 CA SER A 37 25.584 -12.480 -2.657 1.00 0.00 C ATOM 600 C SER A 37 27.057 -12.338 -2.277 1.00 0.00 C ATOM 601 O SER A 37 27.849 -13.255 -2.519 1.00 0.00 O ATOM 602 CB SER A 37 25.147 -11.486 -3.752 1.00 0.00 C ATOM 603 OG SER A 37 25.669 -11.802 -5.028 1.00 0.00 O ATOM 0 H SER A 37 25.257 -11.686 -0.761 1.00 0.00 H new ATOM 0 HA SER A 37 25.439 -13.483 -3.059 1.00 0.00 H new ATOM 0 HB2 SER A 37 24.058 -11.469 -3.805 1.00 0.00 H new ATOM 0 HB3 SER A 37 25.468 -10.483 -3.473 1.00 0.00 H new ATOM 0 HG SER A 37 25.358 -11.141 -5.681 1.00 0.00 H new ATOM 609 N GLY A 38 27.406 -11.243 -1.592 1.00 0.00 N ATOM 610 CA GLY A 38 28.766 -10.958 -1.174 1.00 0.00 C ATOM 611 C GLY A 38 29.634 -10.637 -2.391 1.00 0.00 C ATOM 612 O GLY A 38 29.137 -10.451 -3.499 1.00 0.00 O ATOM 0 H GLY A 38 26.736 -10.526 -1.313 1.00 0.00 H new ATOM 0 HA2 GLY A 38 28.773 -10.117 -0.481 1.00 0.00 H new ATOM 0 HA3 GLY A 38 29.178 -11.814 -0.640 1.00 0.00 H new ATOM 616 N SER A 39 30.944 -10.517 -2.175 1.00 0.00 N ATOM 617 CA SER A 39 31.970 -10.227 -3.186 1.00 0.00 C ATOM 618 C SER A 39 31.830 -8.895 -3.953 1.00 0.00 C ATOM 619 O SER A 39 32.786 -8.480 -4.607 1.00 0.00 O ATOM 620 CB SER A 39 32.095 -11.416 -4.150 1.00 0.00 C ATOM 621 OG SER A 39 32.110 -12.646 -3.444 1.00 0.00 O ATOM 0 H SER A 39 31.343 -10.624 -1.242 1.00 0.00 H new ATOM 0 HA SER A 39 32.890 -10.086 -2.618 1.00 0.00 H new ATOM 0 HB2 SER A 39 31.262 -11.407 -4.853 1.00 0.00 H new ATOM 0 HB3 SER A 39 33.009 -11.318 -4.736 1.00 0.00 H new ATOM 0 HG SER A 39 32.189 -13.387 -4.080 1.00 0.00 H new ATOM 627 N GLY A 40 30.712 -8.171 -3.844 1.00 0.00 N ATOM 628 CA GLY A 40 30.476 -6.900 -4.513 1.00 0.00 C ATOM 629 C GLY A 40 31.128 -5.773 -3.716 1.00 0.00 C ATOM 630 O GLY A 40 30.442 -4.845 -3.284 1.00 0.00 O ATOM 0 H GLY A 40 29.925 -8.468 -3.268 1.00 0.00 H new ATOM 0 HA2 GLY A 40 30.884 -6.928 -5.523 1.00 0.00 H new ATOM 0 HA3 GLY A 40 29.405 -6.720 -4.607 1.00 0.00 H new ATOM 634 N SER A 41 32.451 -5.831 -3.563 1.00 0.00 N ATOM 635 CA SER A 41 33.302 -4.897 -2.831 1.00 0.00 C ATOM 636 C SER A 41 33.212 -3.431 -3.279 1.00 0.00 C ATOM 637 O SER A 41 33.752 -2.568 -2.595 1.00 0.00 O ATOM 638 CB SER A 41 34.751 -5.391 -2.929 1.00 0.00 C ATOM 639 OG SER A 41 34.824 -6.771 -2.610 1.00 0.00 O ATOM 0 H SER A 41 32.994 -6.588 -3.978 1.00 0.00 H new ATOM 0 HA SER A 41 32.938 -4.889 -1.803 1.00 0.00 H new ATOM 0 HB2 SER A 41 35.132 -5.223 -3.936 1.00 0.00 H new ATOM 0 HB3 SER A 41 35.384 -4.820 -2.250 1.00 0.00 H new ATOM 0 HG SER A 41 35.754 -7.074 -2.678 1.00 0.00 H new ATOM 645 N GLY A 42 32.563 -3.124 -4.409 1.00 0.00 N ATOM 646 CA GLY A 42 32.428 -1.749 -4.883 1.00 0.00 C ATOM 647 C GLY A 42 31.537 -0.911 -3.958 1.00 0.00 C ATOM 648 O GLY A 42 31.650 0.314 -3.944 1.00 0.00 O ATOM 0 H GLY A 42 32.122 -3.818 -5.013 1.00 0.00 H new ATOM 0 HA2 GLY A 42 33.414 -1.290 -4.951 1.00 0.00 H new ATOM 0 HA3 GLY A 42 32.007 -1.751 -5.889 1.00 0.00 H new ATOM 652 N SER A 43 30.650 -1.559 -3.188 1.00 0.00 N ATOM 653 CA SER A 43 29.724 -0.947 -2.239 1.00 0.00 C ATOM 654 C SER A 43 28.779 0.112 -2.847 1.00 0.00 C ATOM 655 O SER A 43 28.030 0.732 -2.084 1.00 0.00 O ATOM 656 CB SER A 43 30.532 -0.411 -1.039 1.00 0.00 C ATOM 657 OG SER A 43 29.707 -0.164 0.089 1.00 0.00 O ATOM 0 H SER A 43 30.559 -2.575 -3.216 1.00 0.00 H new ATOM 0 HA SER A 43 29.035 -1.722 -1.904 1.00 0.00 H new ATOM 0 HB2 SER A 43 31.305 -1.131 -0.772 1.00 0.00 H new ATOM 0 HB3 SER A 43 31.039 0.510 -1.326 1.00 0.00 H new ATOM 0 HG SER A 43 28.856 0.221 -0.206 1.00 0.00 H new ATOM 663 N GLY A 44 28.760 0.333 -4.165 1.00 0.00 N ATOM 664 CA GLY A 44 27.909 1.308 -4.832 1.00 0.00 C ATOM 665 C GLY A 44 26.641 0.630 -5.326 1.00 0.00 C ATOM 666 O GLY A 44 25.724 0.393 -4.542 1.00 0.00 O ATOM 0 H GLY A 44 29.357 -0.181 -4.813 1.00 0.00 H new ATOM 0 HA2 GLY A 44 27.657 2.115 -4.144 1.00 0.00 H new ATOM 0 HA3 GLY A 44 28.442 1.758 -5.670 1.00 0.00 H new ATOM 670 N SER A 45 26.593 0.300 -6.619 1.00 0.00 N ATOM 671 CA SER A 45 25.474 -0.365 -7.283 1.00 0.00 C ATOM 672 C SER A 45 24.113 0.354 -7.161 1.00 0.00 C ATOM 673 O SER A 45 23.090 -0.275 -7.458 1.00 0.00 O ATOM 674 CB SER A 45 25.439 -1.826 -6.810 1.00 0.00 C ATOM 675 OG SER A 45 24.607 -2.608 -7.645 1.00 0.00 O ATOM 0 H SER A 45 27.365 0.498 -7.256 1.00 0.00 H new ATOM 0 HA SER A 45 25.651 -0.326 -8.358 1.00 0.00 H new ATOM 0 HB2 SER A 45 26.449 -2.236 -6.809 1.00 0.00 H new ATOM 0 HB3 SER A 45 25.076 -1.871 -5.783 1.00 0.00 H new ATOM 0 HG SER A 45 23.818 -2.087 -7.901 1.00 0.00 H new ATOM 681 N GLY A 46 24.081 1.628 -6.751 1.00 0.00 N ATOM 682 CA GLY A 46 22.876 2.430 -6.584 1.00 0.00 C ATOM 683 C GLY A 46 21.942 2.319 -7.783 1.00 0.00 C ATOM 684 O GLY A 46 22.279 2.781 -8.874 1.00 0.00 O ATOM 0 H GLY A 46 24.930 2.143 -6.519 1.00 0.00 H new ATOM 0 HA2 GLY A 46 22.350 2.110 -5.685 1.00 0.00 H new ATOM 0 HA3 GLY A 46 23.153 3.474 -6.437 1.00 0.00 H new ATOM 688 N SER A 47 20.785 1.692 -7.579 1.00 0.00 N ATOM 689 CA SER A 47 19.756 1.486 -8.588 1.00 0.00 C ATOM 690 C SER A 47 18.417 1.991 -8.041 1.00 0.00 C ATOM 691 O SER A 47 18.226 2.027 -6.822 1.00 0.00 O ATOM 692 CB SER A 47 19.665 -0.012 -8.896 1.00 0.00 C ATOM 693 OG SER A 47 20.933 -0.596 -9.174 1.00 0.00 O ATOM 0 H SER A 47 20.532 1.300 -6.672 1.00 0.00 H new ATOM 0 HA SER A 47 19.999 2.030 -9.500 1.00 0.00 H new ATOM 0 HB2 SER A 47 19.212 -0.526 -8.048 1.00 0.00 H new ATOM 0 HB3 SER A 47 19.005 -0.163 -9.750 1.00 0.00 H new ATOM 0 HG SER A 47 21.513 -0.508 -8.389 1.00 0.00 H new ATOM 699 N GLY A 48 17.472 2.340 -8.914 1.00 0.00 N ATOM 700 CA GLY A 48 16.158 2.825 -8.520 1.00 0.00 C ATOM 701 C GLY A 48 15.501 3.530 -9.697 1.00 0.00 C ATOM 702 O GLY A 48 15.260 2.886 -10.718 1.00 0.00 O ATOM 0 H GLY A 48 17.603 2.292 -9.924 1.00 0.00 H new ATOM 0 HA2 GLY A 48 15.537 1.993 -8.188 1.00 0.00 H new ATOM 0 HA3 GLY A 48 16.250 3.510 -7.677 1.00 0.00 H new ATOM 706 N SER A 49 15.276 4.841 -9.560 1.00 0.00 N ATOM 707 CA SER A 49 14.654 5.720 -10.550 1.00 0.00 C ATOM 708 C SER A 49 13.185 5.340 -10.791 1.00 0.00 C ATOM 709 O SER A 49 12.880 4.592 -11.722 1.00 0.00 O ATOM 710 CB SER A 49 15.472 5.771 -11.855 1.00 0.00 C ATOM 711 OG SER A 49 16.865 5.862 -11.606 1.00 0.00 O ATOM 0 H SER A 49 15.537 5.341 -8.710 1.00 0.00 H new ATOM 0 HA SER A 49 14.654 6.732 -10.144 1.00 0.00 H new ATOM 0 HB2 SER A 49 15.267 4.879 -12.446 1.00 0.00 H new ATOM 0 HB3 SER A 49 15.153 6.627 -12.449 1.00 0.00 H new ATOM 0 HG SER A 49 17.348 5.890 -12.458 1.00 0.00 H new ATOM 717 N GLY A 50 12.270 5.856 -9.961 1.00 0.00 N ATOM 718 CA GLY A 50 10.838 5.594 -10.065 1.00 0.00 C ATOM 719 C GLY A 50 10.026 6.861 -9.809 1.00 0.00 C ATOM 720 O GLY A 50 10.522 7.818 -9.205 1.00 0.00 O ATOM 0 H GLY A 50 12.512 6.476 -9.188 1.00 0.00 H new ATOM 0 HA2 GLY A 50 10.608 5.205 -11.057 1.00 0.00 H new ATOM 0 HA3 GLY A 50 10.553 4.825 -9.347 1.00 0.00 H new ATOM 724 N SER A 51 8.777 6.897 -10.281 1.00 0.00 N ATOM 725 CA SER A 51 7.848 8.018 -10.133 1.00 0.00 C ATOM 726 C SER A 51 6.403 7.539 -10.331 1.00 0.00 C ATOM 727 O SER A 51 6.169 6.444 -10.854 1.00 0.00 O ATOM 728 CB SER A 51 8.204 9.106 -11.158 1.00 0.00 C ATOM 729 OG SER A 51 9.424 9.735 -10.797 1.00 0.00 O ATOM 0 H SER A 51 8.371 6.116 -10.796 1.00 0.00 H new ATOM 0 HA SER A 51 7.932 8.432 -9.128 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.293 8.666 -12.151 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.405 9.846 -11.207 1.00 0.00 H new ATOM 0 HG SER A 51 9.898 9.178 -10.145 1.00 0.00 H new ATOM 735 N GLY A 52 5.430 8.369 -9.951 1.00 0.00 N ATOM 736 CA GLY A 52 4.005 8.077 -10.053 1.00 0.00 C ATOM 737 C GLY A 52 3.202 9.368 -10.003 1.00 0.00 C ATOM 738 O GLY A 52 3.629 10.365 -10.586 1.00 0.00 O ATOM 0 H GLY A 52 5.621 9.289 -9.553 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.800 7.548 -10.984 1.00 0.00 H new ATOM 0 HA3 GLY A 52 3.701 7.419 -9.239 1.00 0.00 H new ATOM 742 N SER A 53 2.059 9.377 -9.317 1.00 0.00 N ATOM 743 CA SER A 53 1.194 10.545 -9.177 1.00 0.00 C ATOM 744 C SER A 53 1.032 10.964 -7.708 1.00 0.00 C ATOM 745 O SER A 53 0.685 12.120 -7.459 1.00 0.00 O ATOM 746 CB SER A 53 -0.159 10.280 -9.861 1.00 0.00 C ATOM 747 OG SER A 53 -0.590 11.424 -10.583 1.00 0.00 O ATOM 0 H SER A 53 1.702 8.553 -8.833 1.00 0.00 H new ATOM 0 HA SER A 53 1.667 11.389 -9.679 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.070 9.430 -10.537 1.00 0.00 H new ATOM 0 HB3 SER A 53 -0.905 10.015 -9.112 1.00 0.00 H new ATOM 0 HG SER A 53 -1.451 11.235 -11.012 1.00 0.00 H new ATOM 753 N GLY A 54 1.312 10.096 -6.731 1.00 0.00 N ATOM 754 CA GLY A 54 1.185 10.446 -5.324 1.00 0.00 C ATOM 755 C GLY A 54 1.679 9.321 -4.425 1.00 0.00 C ATOM 756 O GLY A 54 1.868 8.193 -4.882 1.00 0.00 O ATOM 0 H GLY A 54 1.630 9.141 -6.897 1.00 0.00 H new ATOM 0 HA2 GLY A 54 1.754 11.353 -5.120 1.00 0.00 H new ATOM 0 HA3 GLY A 54 0.142 10.666 -5.095 1.00 0.00 H new ATOM 760 N SER A 55 1.871 9.634 -3.145 1.00 0.00 N ATOM 761 CA SER A 55 2.336 8.698 -2.130 1.00 0.00 C ATOM 762 C SER A 55 1.390 8.736 -0.926 1.00 0.00 C ATOM 763 O SER A 55 0.691 9.728 -0.695 1.00 0.00 O ATOM 764 CB SER A 55 3.774 9.049 -1.727 1.00 0.00 C ATOM 765 OG SER A 55 4.659 8.999 -2.831 1.00 0.00 O ATOM 0 H SER A 55 1.702 10.571 -2.778 1.00 0.00 H new ATOM 0 HA SER A 55 2.335 7.684 -2.529 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.795 10.047 -1.290 1.00 0.00 H new ATOM 0 HB3 SER A 55 4.115 8.357 -0.957 1.00 0.00 H new ATOM 0 HG SER A 55 5.464 9.520 -2.629 1.00 0.00 H new ATOM 771 N GLY A 56 1.385 7.661 -0.135 1.00 0.00 N ATOM 772 CA GLY A 56 0.554 7.498 1.052 1.00 0.00 C ATOM 773 C GLY A 56 0.734 8.658 2.028 1.00 0.00 C ATOM 774 O GLY A 56 1.827 9.220 2.148 1.00 0.00 O ATOM 0 H GLY A 56 1.982 6.853 -0.313 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -0.493 7.429 0.757 1.00 0.00 H new ATOM 0 HA3 GLY A 56 0.808 6.561 1.549 1.00 0.00 H new ATOM 778 N SER A 57 -0.331 8.973 2.752 1.00 0.00 N ATOM 779 CA SER A 57 -0.418 10.056 3.719 1.00 0.00 C ATOM 780 C SER A 57 -0.104 9.623 5.162 1.00 0.00 C ATOM 781 O SER A 57 0.054 8.438 5.473 1.00 0.00 O ATOM 782 CB SER A 57 -1.851 10.596 3.592 1.00 0.00 C ATOM 783 OG SER A 57 -2.129 10.895 2.231 1.00 0.00 O ATOM 0 H SER A 57 -1.204 8.451 2.676 1.00 0.00 H new ATOM 0 HA SER A 57 0.334 10.815 3.505 1.00 0.00 H new ATOM 0 HB2 SER A 57 -2.562 9.859 3.966 1.00 0.00 H new ATOM 0 HB3 SER A 57 -1.969 11.491 4.203 1.00 0.00 H new ATOM 0 HG SER A 57 -3.044 11.238 2.152 1.00 0.00 H new ATOM 789 N GLY A 58 -0.069 10.590 6.078 1.00 0.00 N ATOM 790 CA GLY A 58 0.195 10.365 7.491 1.00 0.00 C ATOM 791 C GLY A 58 1.680 10.251 7.824 1.00 0.00 C ATOM 792 O GLY A 58 2.546 10.493 6.983 1.00 0.00 O ATOM 0 H GLY A 58 -0.227 11.571 5.849 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -0.236 11.183 8.068 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -0.311 9.452 7.806 1.00 0.00 H new ATOM 796 N TYR A 59 1.972 9.863 9.066 1.00 0.00 N ATOM 797 CA TYR A 59 3.297 9.686 9.671 1.00 0.00 C ATOM 798 C TYR A 59 4.147 8.549 9.064 1.00 0.00 C ATOM 799 O TYR A 59 4.864 7.847 9.787 1.00 0.00 O ATOM 800 CB TYR A 59 3.148 9.529 11.200 1.00 0.00 C ATOM 801 CG TYR A 59 2.081 10.392 11.856 1.00 0.00 C ATOM 802 CD1 TYR A 59 2.029 11.777 11.608 1.00 0.00 C ATOM 803 CD2 TYR A 59 1.116 9.798 12.694 1.00 0.00 C ATOM 804 CE1 TYR A 59 1.000 12.560 12.157 1.00 0.00 C ATOM 805 CE2 TYR A 59 0.087 10.575 13.252 1.00 0.00 C ATOM 806 CZ TYR A 59 0.017 11.958 12.972 1.00 0.00 C ATOM 807 OH TYR A 59 -0.970 12.705 13.540 1.00 0.00 O ATOM 0 H TYR A 59 1.229 9.646 9.730 1.00 0.00 H new ATOM 0 HA TYR A 59 3.862 10.589 9.439 1.00 0.00 H new ATOM 0 HB2 TYR A 59 2.928 8.484 11.419 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.108 9.756 11.664 1.00 0.00 H new ATOM 0 HD1 TYR A 59 2.785 12.240 10.992 1.00 0.00 H new ATOM 0 HD2 TYR A 59 1.168 8.741 12.908 1.00 0.00 H new ATOM 0 HE1 TYR A 59 0.961 13.620 11.956 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -0.650 10.116 13.894 1.00 0.00 H new ATOM 0 HH TYR A 59 -1.558 12.124 14.067 1.00 0.00 H new ATOM 817 N GLN A3288 3.986 8.239 7.777 1.00 0.00 N ATOM 818 CA GLN A3288 4.767 7.214 7.099 1.00 0.00 C ATOM 819 C GLN A3288 6.111 7.844 6.683 1.00 0.00 C ATOM 820 O GLN A3288 6.318 9.046 6.857 1.00 0.00 O ATOM 821 CB GLN A3288 3.949 6.599 5.955 1.00 0.00 C ATOM 822 CG GLN A3288 3.554 7.559 4.828 1.00 0.00 C ATOM 823 CD GLN A3288 2.957 6.744 3.691 1.00 0.00 C ATOM 824 OE1 GLN A3288 1.923 6.097 3.829 1.00 0.00 O ATOM 825 NE2 GLN A3288 3.619 6.697 2.551 1.00 0.00 N ATOM 0 H GLN A3288 3.303 8.698 7.174 1.00 0.00 H new ATOM 0 HA GLN A3288 5.001 6.371 7.750 1.00 0.00 H new ATOM 0 HB2 GLN A3288 4.522 5.778 5.524 1.00 0.00 H new ATOM 0 HB3 GLN A3288 3.040 6.167 6.374 1.00 0.00 H new ATOM 0 HG2 GLN A3288 2.832 8.292 5.189 1.00 0.00 H new ATOM 0 HG3 GLN A3288 4.425 8.114 4.480 1.00 0.00 H new ATOM 0 HE21 GLN A3288 4.478 7.235 2.438 1.00 0.00 H new ATOM 0 HE22 GLN A3288 3.272 6.123 1.783 1.00 0.00 H new ATOM 834 N ILE A3289 7.035 7.051 6.134 1.00 0.00 N ATOM 835 CA ILE A3289 8.359 7.504 5.712 1.00 0.00 C ATOM 836 C ILE A3289 8.360 7.690 4.188 1.00 0.00 C ATOM 837 O ILE A3289 8.593 6.758 3.416 1.00 0.00 O ATOM 838 CB ILE A3289 9.466 6.559 6.233 1.00 0.00 C ATOM 839 CG1 ILE A3289 9.320 6.221 7.739 1.00 0.00 C ATOM 840 CG2 ILE A3289 10.822 7.243 5.991 1.00 0.00 C ATOM 841 CD1 ILE A3289 10.190 5.037 8.177 1.00 0.00 C ATOM 0 H ILE A3289 6.879 6.057 5.968 1.00 0.00 H new ATOM 0 HA ILE A3289 8.588 8.473 6.156 1.00 0.00 H new ATOM 0 HB ILE A3289 9.385 5.614 5.695 1.00 0.00 H new ATOM 0 HG12 ILE A3289 9.586 7.098 8.329 1.00 0.00 H new ATOM 0 HG13 ILE A3289 8.276 5.996 7.955 1.00 0.00 H new ATOM 0 HG21 ILE A3289 11.624 6.598 6.350 1.00 0.00 H new ATOM 0 HG22 ILE A3289 10.952 7.425 4.924 1.00 0.00 H new ATOM 0 HG23 ILE A3289 10.852 8.191 6.527 1.00 0.00 H new ATOM 0 HD11 ILE A3289 10.043 4.851 9.241 1.00 0.00 H new ATOM 0 HD12 ILE A3289 9.908 4.149 7.611 1.00 0.00 H new ATOM 0 HD13 ILE A3289 11.239 5.268 7.991 1.00 0.00 H new ATOM 853 N GLU A3290 8.113 8.924 3.769 1.00 0.00 N ATOM 854 CA GLU A3290 8.036 9.396 2.390 1.00 0.00 C ATOM 855 C GLU A3290 9.367 9.316 1.618 1.00 0.00 C ATOM 856 O GLU A3290 9.412 9.515 0.403 1.00 0.00 O ATOM 857 CB GLU A3290 7.535 10.842 2.477 1.00 0.00 C ATOM 858 CG GLU A3290 6.987 11.384 1.153 1.00 0.00 C ATOM 859 CD GLU A3290 5.781 12.281 1.432 1.00 0.00 C ATOM 860 OE1 GLU A3290 4.713 11.735 1.798 1.00 0.00 O ATOM 861 OE2 GLU A3290 5.906 13.526 1.368 1.00 0.00 O ATOM 0 H GLU A3290 7.949 9.680 4.434 1.00 0.00 H new ATOM 0 HA GLU A3290 7.366 8.751 1.822 1.00 0.00 H new ATOM 0 HB2 GLU A3290 6.754 10.902 3.235 1.00 0.00 H new ATOM 0 HB3 GLU A3290 8.353 11.481 2.811 1.00 0.00 H new ATOM 0 HG2 GLU A3290 7.760 11.947 0.630 1.00 0.00 H new ATOM 0 HG3 GLU A3290 6.698 10.559 0.502 1.00 0.00 H new ATOM 868 N THR A3291 10.458 8.983 2.305 1.00 0.00 N ATOM 869 CA THR A3291 11.795 8.886 1.734 1.00 0.00 C ATOM 870 C THR A3291 12.459 7.534 2.031 1.00 0.00 C ATOM 871 O THR A3291 13.677 7.451 2.193 1.00 0.00 O ATOM 872 CB THR A3291 12.549 10.176 2.129 1.00 0.00 C ATOM 873 OG1 THR A3291 13.669 10.440 1.305 1.00 0.00 O ATOM 874 CG2 THR A3291 12.949 10.218 3.609 1.00 0.00 C ATOM 0 H THR A3291 10.433 8.768 3.302 1.00 0.00 H new ATOM 0 HA THR A3291 11.791 8.859 0.644 1.00 0.00 H new ATOM 0 HB THR A3291 11.824 10.973 1.966 1.00 0.00 H new ATOM 0 HG1 THR A3291 14.105 11.267 1.600 1.00 0.00 H new ATOM 0 HG21 THR A3291 13.474 11.150 3.818 1.00 0.00 H new ATOM 0 HG22 THR A3291 12.055 10.159 4.229 1.00 0.00 H new ATOM 0 HG23 THR A3291 13.603 9.375 3.833 1.00 0.00 H new ATOM 882 N PHE A3292 11.656 6.469 2.143 1.00 0.00 N ATOM 883 CA PHE A3292 12.146 5.123 2.418 1.00 0.00 C ATOM 884 C PHE A3292 11.377 4.059 1.638 1.00 0.00 C ATOM 885 O PHE A3292 11.993 3.113 1.141 1.00 0.00 O ATOM 886 CB PHE A3292 12.072 4.881 3.925 1.00 0.00 C ATOM 887 CG PHE A3292 12.577 3.528 4.402 1.00 0.00 C ATOM 888 CD1 PHE A3292 13.805 3.010 3.950 1.00 0.00 C ATOM 889 CD2 PHE A3292 11.797 2.766 5.289 1.00 0.00 C ATOM 890 CE1 PHE A3292 14.207 1.716 4.327 1.00 0.00 C ATOM 891 CE2 PHE A3292 12.189 1.468 5.658 1.00 0.00 C ATOM 892 CZ PHE A3292 13.390 0.938 5.163 1.00 0.00 C ATOM 0 H PHE A3292 10.642 6.523 2.044 1.00 0.00 H new ATOM 0 HA PHE A3292 13.181 5.044 2.084 1.00 0.00 H new ATOM 0 HB2 PHE A3292 12.645 5.660 4.428 1.00 0.00 H new ATOM 0 HB3 PHE A3292 11.035 4.993 4.242 1.00 0.00 H new ATOM 0 HD1 PHE A3292 14.440 3.607 3.312 1.00 0.00 H new ATOM 0 HD2 PHE A3292 10.886 3.183 5.692 1.00 0.00 H new ATOM 0 HE1 PHE A3292 15.147 1.320 3.972 1.00 0.00 H new ATOM 0 HE2 PHE A3292 11.569 0.881 6.319 1.00 0.00 H new ATOM 0 HZ PHE A3292 13.686 -0.067 5.425 1.00 0.00 H new ATOM 902 N PHE A3293 10.053 4.189 1.503 1.00 0.00 N ATOM 903 CA PHE A3293 9.238 3.223 0.761 1.00 0.00 C ATOM 904 C PHE A3293 8.220 3.899 -0.148 1.00 0.00 C ATOM 905 O PHE A3293 7.363 3.205 -0.688 1.00 0.00 O ATOM 906 CB PHE A3293 8.584 2.198 1.713 1.00 0.00 C ATOM 907 CG PHE A3293 8.177 2.748 3.065 1.00 0.00 C ATOM 908 CD1 PHE A3293 8.722 2.222 4.250 1.00 0.00 C ATOM 909 CD2 PHE A3293 7.269 3.816 3.134 1.00 0.00 C ATOM 910 CE1 PHE A3293 8.320 2.734 5.498 1.00 0.00 C ATOM 911 CE2 PHE A3293 6.885 4.335 4.374 1.00 0.00 C ATOM 912 CZ PHE A3293 7.383 3.777 5.566 1.00 0.00 C ATOM 0 H PHE A3293 9.520 4.961 1.902 1.00 0.00 H new ATOM 0 HA PHE A3293 9.909 2.673 0.102 1.00 0.00 H new ATOM 0 HB2 PHE A3293 7.701 1.784 1.226 1.00 0.00 H new ATOM 0 HB3 PHE A3293 9.280 1.373 1.868 1.00 0.00 H new ATOM 0 HD1 PHE A3293 9.449 1.425 4.202 1.00 0.00 H new ATOM 0 HD2 PHE A3293 6.865 4.238 2.226 1.00 0.00 H new ATOM 0 HE1 PHE A3293 8.734 2.323 6.407 1.00 0.00 H new ATOM 0 HE2 PHE A3293 6.201 5.170 4.417 1.00 0.00 H new ATOM 0 HZ PHE A3293 7.048 4.147 6.523 1.00 0.00 H new ATOM 922 N ALA A3294 8.265 5.225 -0.322 1.00 0.00 N ATOM 923 CA ALA A3294 7.325 5.952 -1.176 1.00 0.00 C ATOM 924 C ALA A3294 7.291 5.369 -2.588 1.00 0.00 C ATOM 925 O ALA A3294 6.239 5.361 -3.223 1.00 0.00 O ATOM 926 CB ALA A3294 7.651 7.436 -1.201 1.00 0.00 C ATOM 0 H ALA A3294 8.957 5.824 0.128 1.00 0.00 H new ATOM 0 HA ALA A3294 6.329 5.835 -0.750 1.00 0.00 H new ATOM 0 HB1 ALA A3294 6.938 7.954 -1.842 1.00 0.00 H new ATOM 0 HB2 ALA A3294 7.589 7.839 -0.190 1.00 0.00 H new ATOM 0 HB3 ALA A3294 8.660 7.580 -1.588 1.00 0.00 H new ATOM 932 N GLN A3295 8.433 4.863 -3.056 1.00 0.00 N ATOM 933 CA GLN A3295 8.582 4.259 -4.379 1.00 0.00 C ATOM 934 C GLN A3295 7.612 3.083 -4.539 1.00 0.00 C ATOM 935 O GLN A3295 7.059 2.888 -5.612 1.00 0.00 O ATOM 936 CB GLN A3295 10.040 3.830 -4.583 1.00 0.00 C ATOM 937 CG GLN A3295 11.050 4.974 -4.419 1.00 0.00 C ATOM 938 CD GLN A3295 11.082 5.925 -5.616 1.00 0.00 C ATOM 939 OE1 GLN A3295 12.013 5.863 -6.418 1.00 0.00 O ATOM 940 NE2 GLN A3295 10.127 6.832 -5.753 1.00 0.00 N ATOM 0 H GLN A3295 9.297 4.862 -2.514 1.00 0.00 H new ATOM 0 HA GLN A3295 8.333 4.990 -5.149 1.00 0.00 H new ATOM 0 HB2 GLN A3295 10.280 3.041 -3.871 1.00 0.00 H new ATOM 0 HB3 GLN A3295 10.147 3.403 -5.580 1.00 0.00 H new ATOM 0 HG2 GLN A3295 10.806 5.540 -3.520 1.00 0.00 H new ATOM 0 HG3 GLN A3295 12.045 4.554 -4.270 1.00 0.00 H new ATOM 0 HE21 GLN A3295 9.361 6.872 -5.080 1.00 0.00 H new ATOM 0 HE22 GLN A3295 10.157 7.491 -6.531 1.00 0.00 H new ATOM 949 N ASP A3296 7.471 2.250 -3.511 1.00 0.00 N ATOM 950 CA ASP A3296 6.537 1.124 -3.520 1.00 0.00 C ATOM 951 C ASP A3296 5.132 1.600 -3.187 1.00 0.00 C ATOM 952 O ASP A3296 4.131 1.167 -3.745 1.00 0.00 O ATOM 953 CB ASP A3296 6.892 0.094 -2.436 1.00 0.00 C ATOM 954 CG ASP A3296 7.922 -0.946 -2.831 1.00 0.00 C ATOM 955 OD1 ASP A3296 8.903 -0.620 -3.532 1.00 0.00 O ATOM 956 OD2 ASP A3296 7.803 -2.072 -2.290 1.00 0.00 O ATOM 0 H ASP A3296 8.002 2.336 -2.645 1.00 0.00 H new ATOM 0 HA ASP A3296 6.596 0.683 -4.515 1.00 0.00 H new ATOM 0 HB2 ASP A3296 7.259 0.628 -1.559 1.00 0.00 H new ATOM 0 HB3 ASP A3296 5.979 -0.421 -2.137 1.00 0.00 H new ATOM 961 N ILE A3297 5.042 2.493 -2.207 1.00 0.00 N ATOM 962 CA ILE A3297 3.800 3.037 -1.703 1.00 0.00 C ATOM 963 C ILE A3297 2.941 3.617 -2.815 1.00 0.00 C ATOM 964 O ILE A3297 1.735 3.385 -2.783 1.00 0.00 O ATOM 965 CB ILE A3297 4.145 4.049 -0.584 1.00 0.00 C ATOM 966 CG1 ILE A3297 3.843 3.486 0.808 1.00 0.00 C ATOM 967 CG2 ILE A3297 3.484 5.416 -0.766 1.00 0.00 C ATOM 968 CD1 ILE A3297 4.680 2.252 1.163 1.00 0.00 C ATOM 0 H ILE A3297 5.863 2.866 -1.730 1.00 0.00 H new ATOM 0 HA ILE A3297 3.182 2.248 -1.276 1.00 0.00 H new ATOM 0 HB ILE A3297 5.220 4.210 -0.668 1.00 0.00 H new ATOM 0 HG12 ILE A3297 4.021 4.262 1.552 1.00 0.00 H new ATOM 0 HG13 ILE A3297 2.786 3.227 0.865 1.00 0.00 H new ATOM 0 HG21 ILE A3297 3.772 6.072 0.056 1.00 0.00 H new ATOM 0 HG22 ILE A3297 3.808 5.854 -1.710 1.00 0.00 H new ATOM 0 HG23 ILE A3297 2.400 5.298 -0.774 1.00 0.00 H new ATOM 0 HD11 ILE A3297 4.414 1.907 2.162 1.00 0.00 H new ATOM 0 HD12 ILE A3297 4.484 1.459 0.441 1.00 0.00 H new ATOM 0 HD13 ILE A3297 5.738 2.511 1.139 1.00 0.00 H new ATOM 980 N GLU A3298 3.543 4.351 -3.747 1.00 0.00 N ATOM 981 CA GLU A3298 2.882 4.992 -4.872 1.00 0.00 C ATOM 982 C GLU A3298 2.248 3.933 -5.777 1.00 0.00 C ATOM 983 O GLU A3298 1.145 4.119 -6.277 1.00 0.00 O ATOM 984 CB GLU A3298 3.928 5.876 -5.585 1.00 0.00 C ATOM 985 CG GLU A3298 4.972 5.067 -6.376 1.00 0.00 C ATOM 986 CD GLU A3298 4.550 4.694 -7.805 1.00 0.00 C ATOM 987 OE1 GLU A3298 3.551 5.246 -8.322 1.00 0.00 O ATOM 988 OE2 GLU A3298 5.187 3.812 -8.418 1.00 0.00 O ATOM 0 H GLU A3298 4.549 4.520 -3.735 1.00 0.00 H new ATOM 0 HA GLU A3298 2.060 5.633 -4.552 1.00 0.00 H new ATOM 0 HB2 GLU A3298 3.415 6.557 -6.264 1.00 0.00 H new ATOM 0 HB3 GLU A3298 4.440 6.490 -4.844 1.00 0.00 H new ATOM 0 HG2 GLU A3298 5.897 5.642 -6.424 1.00 0.00 H new ATOM 0 HG3 GLU A3298 5.194 4.152 -5.827 1.00 0.00 H new ATOM 995 N SER A3299 2.934 2.803 -5.940 1.00 0.00 N ATOM 996 CA SER A3299 2.536 1.673 -6.767 1.00 0.00 C ATOM 997 C SER A3299 1.352 0.962 -6.122 1.00 0.00 C ATOM 998 O SER A3299 0.355 0.646 -6.774 1.00 0.00 O ATOM 999 CB SER A3299 3.757 0.757 -6.962 1.00 0.00 C ATOM 1000 OG SER A3299 3.450 -0.485 -7.571 1.00 0.00 O ATOM 0 H SER A3299 3.827 2.646 -5.474 1.00 0.00 H new ATOM 0 HA SER A3299 2.205 1.999 -7.753 1.00 0.00 H new ATOM 0 HB2 SER A3299 4.496 1.277 -7.572 1.00 0.00 H new ATOM 0 HB3 SER A3299 4.218 0.571 -5.992 1.00 0.00 H new ATOM 0 HG SER A3299 4.269 -1.014 -7.665 1.00 0.00 H new ATOM 1006 N VAL A3300 1.451 0.727 -4.820 1.00 0.00 N ATOM 1007 CA VAL A3300 0.427 0.058 -4.047 1.00 0.00 C ATOM 1008 C VAL A3300 -0.817 0.944 -3.982 1.00 0.00 C ATOM 1009 O VAL A3300 -1.929 0.506 -4.262 1.00 0.00 O ATOM 1010 CB VAL A3300 1.015 -0.267 -2.661 1.00 0.00 C ATOM 1011 CG1 VAL A3300 -0.060 -0.787 -1.707 1.00 0.00 C ATOM 1012 CG2 VAL A3300 2.156 -1.293 -2.732 1.00 0.00 C ATOM 0 H VAL A3300 2.262 1.003 -4.267 1.00 0.00 H new ATOM 0 HA VAL A3300 0.116 -0.880 -4.508 1.00 0.00 H new ATOM 0 HB VAL A3300 1.418 0.672 -2.282 1.00 0.00 H new ATOM 0 HG11 VAL A3300 0.389 -1.007 -0.738 1.00 0.00 H new ATOM 0 HG12 VAL A3300 -0.835 -0.030 -1.585 1.00 0.00 H new ATOM 0 HG13 VAL A3300 -0.501 -1.695 -2.117 1.00 0.00 H new ATOM 0 HG21 VAL A3300 2.535 -1.486 -1.728 1.00 0.00 H new ATOM 0 HG22 VAL A3300 1.784 -2.222 -3.164 1.00 0.00 H new ATOM 0 HG23 VAL A3300 2.960 -0.900 -3.354 1.00 0.00 H new ATOM 1022 N GLN A3301 -0.664 2.209 -3.597 1.00 0.00 N ATOM 1023 CA GLN A3301 -1.786 3.121 -3.480 1.00 0.00 C ATOM 1024 C GLN A3301 -2.457 3.354 -4.829 1.00 0.00 C ATOM 1025 O GLN A3301 -3.666 3.578 -4.841 1.00 0.00 O ATOM 1026 CB GLN A3301 -1.407 4.372 -2.691 1.00 0.00 C ATOM 1027 CG GLN A3301 -0.525 5.374 -3.437 1.00 0.00 C ATOM 1028 CD GLN A3301 -1.259 6.683 -3.665 1.00 0.00 C ATOM 1029 OE1 GLN A3301 -0.914 7.707 -3.088 1.00 0.00 O ATOM 1030 NE2 GLN A3301 -2.343 6.646 -4.418 1.00 0.00 N ATOM 0 H GLN A3301 0.237 2.623 -3.360 1.00 0.00 H new ATOM 0 HA GLN A3301 -2.568 2.659 -2.877 1.00 0.00 H new ATOM 0 HB2 GLN A3301 -2.322 4.878 -2.383 1.00 0.00 H new ATOM 0 HB3 GLN A3301 -0.890 4.065 -1.782 1.00 0.00 H new ATOM 0 HG2 GLN A3301 0.385 5.558 -2.866 1.00 0.00 H new ATOM 0 HG3 GLN A3301 -0.220 4.953 -4.395 1.00 0.00 H new ATOM 0 HE21 GLN A3301 -2.608 5.780 -4.888 1.00 0.00 H new ATOM 0 HE22 GLN A3301 -2.915 7.483 -4.530 1.00 0.00 H new ATOM 1039 N LYS A3302 -1.708 3.298 -5.939 1.00 0.00 N ATOM 1040 CA LYS A3302 -2.235 3.460 -7.293 1.00 0.00 C ATOM 1041 C LYS A3302 -3.308 2.410 -7.572 1.00 0.00 C ATOM 1042 O LYS A3302 -4.193 2.641 -8.397 1.00 0.00 O ATOM 1043 CB LYS A3302 -1.119 3.344 -8.338 1.00 0.00 C ATOM 1044 CG LYS A3302 -0.643 4.707 -8.845 1.00 0.00 C ATOM 1045 CD LYS A3302 0.605 4.587 -9.732 1.00 0.00 C ATOM 1046 CE LYS A3302 0.412 3.638 -10.920 1.00 0.00 C ATOM 1047 NZ LYS A3302 1.545 3.668 -11.864 1.00 0.00 N ATOM 0 H LYS A3302 -0.701 3.136 -5.916 1.00 0.00 H new ATOM 0 HA LYS A3302 -2.674 4.455 -7.363 1.00 0.00 H new ATOM 0 HB2 LYS A3302 -0.275 2.807 -7.905 1.00 0.00 H new ATOM 0 HB3 LYS A3302 -1.476 2.751 -9.181 1.00 0.00 H new ATOM 0 HG2 LYS A3302 -1.444 5.184 -9.409 1.00 0.00 H new ATOM 0 HG3 LYS A3302 -0.423 5.353 -7.995 1.00 0.00 H new ATOM 0 HD2 LYS A3302 0.874 5.575 -10.105 1.00 0.00 H new ATOM 0 HD3 LYS A3302 1.441 4.236 -9.127 1.00 0.00 H new ATOM 0 HE2 LYS A3302 0.280 2.621 -10.550 1.00 0.00 H new ATOM 0 HE3 LYS A3302 -0.503 3.906 -11.449 1.00 0.00 H new ATOM 0 HZ1 LYS A3302 1.362 3.008 -12.647 1.00 0.00 H new ATOM 0 HZ2 LYS A3302 1.657 4.631 -12.241 1.00 0.00 H new ATOM 0 HZ3 LYS A3302 2.416 3.386 -11.370 1.00 0.00 H new ATOM 1061 N GLU A3303 -3.227 1.256 -6.918 1.00 0.00 N ATOM 1062 CA GLU A3303 -4.216 0.208 -7.113 1.00 0.00 C ATOM 1063 C GLU A3303 -5.502 0.551 -6.349 1.00 0.00 C ATOM 1064 O GLU A3303 -6.606 0.451 -6.879 1.00 0.00 O ATOM 1065 CB GLU A3303 -3.590 -1.172 -6.823 1.00 0.00 C ATOM 1066 CG GLU A3303 -3.873 -1.767 -5.442 1.00 0.00 C ATOM 1067 CD GLU A3303 -2.855 -2.843 -5.057 1.00 0.00 C ATOM 1068 OE1 GLU A3303 -2.712 -3.832 -5.811 1.00 0.00 O ATOM 1069 OE2 GLU A3303 -2.202 -2.728 -3.992 1.00 0.00 O ATOM 0 H GLU A3303 -2.490 1.026 -6.252 1.00 0.00 H new ATOM 0 HA GLU A3303 -4.531 0.145 -8.155 1.00 0.00 H new ATOM 0 HB2 GLU A3303 -3.945 -1.874 -7.577 1.00 0.00 H new ATOM 0 HB3 GLU A3303 -2.510 -1.091 -6.946 1.00 0.00 H new ATOM 0 HG2 GLU A3303 -3.859 -0.972 -4.696 1.00 0.00 H new ATOM 0 HG3 GLU A3303 -4.875 -2.196 -5.432 1.00 0.00 H new ATOM 1076 N LEU A3304 -5.368 1.062 -5.127 1.00 0.00 N ATOM 1077 CA LEU A3304 -6.470 1.391 -4.245 1.00 0.00 C ATOM 1078 C LEU A3304 -7.323 2.557 -4.709 1.00 0.00 C ATOM 1079 O LEU A3304 -8.527 2.539 -4.488 1.00 0.00 O ATOM 1080 CB LEU A3304 -5.902 1.659 -2.850 1.00 0.00 C ATOM 1081 CG LEU A3304 -5.070 0.488 -2.291 1.00 0.00 C ATOM 1082 CD1 LEU A3304 -4.466 0.878 -0.957 1.00 0.00 C ATOM 1083 CD2 LEU A3304 -5.837 -0.822 -2.143 1.00 0.00 C ATOM 0 H LEU A3304 -4.456 1.263 -4.716 1.00 0.00 H new ATOM 0 HA LEU A3304 -7.148 0.538 -4.242 1.00 0.00 H new ATOM 0 HB2 LEU A3304 -5.279 2.553 -2.885 1.00 0.00 H new ATOM 0 HB3 LEU A3304 -6.724 1.870 -2.166 1.00 0.00 H new ATOM 0 HG LEU A3304 -4.294 0.297 -3.032 1.00 0.00 H new ATOM 0 HD11 LEU A3304 -3.879 0.047 -0.566 1.00 0.00 H new ATOM 0 HD12 LEU A3304 -3.821 1.747 -1.090 1.00 0.00 H new ATOM 0 HD13 LEU A3304 -5.263 1.121 -0.254 1.00 0.00 H new ATOM 0 HD21 LEU A3304 -5.173 -1.589 -1.744 1.00 0.00 H new ATOM 0 HD22 LEU A3304 -6.676 -0.678 -1.462 1.00 0.00 H new ATOM 0 HD23 LEU A3304 -6.211 -1.137 -3.117 1.00 0.00 H new ATOM 1095 N GLU A3305 -6.731 3.564 -5.343 1.00 0.00 N ATOM 1096 CA GLU A3305 -7.442 4.745 -5.850 1.00 0.00 C ATOM 1097 C GLU A3305 -8.457 4.400 -6.946 1.00 0.00 C ATOM 1098 O GLU A3305 -9.220 5.278 -7.353 1.00 0.00 O ATOM 1099 CB GLU A3305 -6.448 5.813 -6.344 1.00 0.00 C ATOM 1100 CG GLU A3305 -5.482 5.194 -7.355 1.00 0.00 C ATOM 1101 CD GLU A3305 -4.411 6.147 -7.881 1.00 0.00 C ATOM 1102 OE1 GLU A3305 -4.232 6.209 -9.123 1.00 0.00 O ATOM 1103 OE2 GLU A3305 -3.668 6.716 -7.055 1.00 0.00 O ATOM 0 H GLU A3305 -5.728 3.588 -5.525 1.00 0.00 H new ATOM 0 HA GLU A3305 -8.009 5.152 -5.013 1.00 0.00 H new ATOM 0 HB2 GLU A3305 -6.988 6.641 -6.803 1.00 0.00 H new ATOM 0 HB3 GLU A3305 -5.892 6.224 -5.501 1.00 0.00 H new ATOM 0 HG2 GLU A3305 -4.991 4.338 -6.891 1.00 0.00 H new ATOM 0 HG3 GLU A3305 -6.056 4.813 -8.199 1.00 0.00 H new ATOM 1110 N ASN A3306 -8.390 3.185 -7.503 1.00 0.00 N ATOM 1111 CA ASN A3306 -9.308 2.695 -8.524 1.00 0.00 C ATOM 1112 C ASN A3306 -10.140 1.510 -8.020 1.00 0.00 C ATOM 1113 O ASN A3306 -10.996 1.037 -8.768 1.00 0.00 O ATOM 1114 CB ASN A3306 -8.593 2.391 -9.850 1.00 0.00 C ATOM 1115 CG ASN A3306 -7.761 1.118 -9.846 1.00 0.00 C ATOM 1116 OD1 ASN A3306 -8.266 0.004 -9.963 1.00 0.00 O ATOM 1117 ND2 ASN A3306 -6.450 1.252 -9.759 1.00 0.00 N ATOM 0 H ASN A3306 -7.677 2.503 -7.246 1.00 0.00 H new ATOM 0 HA ASN A3306 -10.010 3.502 -8.735 1.00 0.00 H new ATOM 0 HB2 ASN A3306 -9.339 2.319 -10.641 1.00 0.00 H new ATOM 0 HB3 ASN A3306 -7.945 3.232 -10.099 1.00 0.00 H new ATOM 0 HD21 ASN A3306 -5.850 0.428 -9.789 1.00 0.00 H new ATOM 0 HD22 ASN A3306 -6.038 2.180 -9.662 1.00 0.00 H new ATOM 1124 N LEU A3307 -9.888 0.989 -6.810 1.00 0.00 N ATOM 1125 CA LEU A3307 -10.661 -0.149 -6.301 1.00 0.00 C ATOM 1126 C LEU A3307 -12.010 0.317 -5.737 1.00 0.00 C ATOM 1127 O LEU A3307 -12.124 1.464 -5.311 1.00 0.00 O ATOM 1128 CB LEU A3307 -9.861 -0.930 -5.232 1.00 0.00 C ATOM 1129 CG LEU A3307 -9.244 -2.304 -5.595 1.00 0.00 C ATOM 1130 CD1 LEU A3307 -9.779 -2.947 -6.868 1.00 0.00 C ATOM 1131 CD2 LEU A3307 -7.727 -2.315 -5.704 1.00 0.00 C ATOM 0 H LEU A3307 -9.167 1.332 -6.176 1.00 0.00 H new ATOM 0 HA LEU A3307 -10.855 -0.823 -7.136 1.00 0.00 H new ATOM 0 HB2 LEU A3307 -9.049 -0.285 -4.896 1.00 0.00 H new ATOM 0 HB3 LEU A3307 -10.520 -1.083 -4.378 1.00 0.00 H new ATOM 0 HG LEU A3307 -9.562 -2.890 -4.733 1.00 0.00 H new ATOM 0 HD11 LEU A3307 -9.281 -3.903 -7.029 1.00 0.00 H new ATOM 0 HD12 LEU A3307 -10.853 -3.108 -6.771 1.00 0.00 H new ATOM 0 HD13 LEU A3307 -9.586 -2.290 -7.716 1.00 0.00 H new ATOM 0 HD21 LEU A3307 -7.388 -3.318 -5.961 1.00 0.00 H new ATOM 0 HD22 LEU A3307 -7.413 -1.616 -6.479 1.00 0.00 H new ATOM 0 HD23 LEU A3307 -7.291 -2.018 -4.750 1.00 0.00 H new ATOM 1143 N SER A3308 -13.003 -0.581 -5.721 1.00 0.00 N ATOM 1144 CA SER A3308 -14.368 -0.376 -5.227 1.00 0.00 C ATOM 1145 C SER A3308 -14.448 -0.558 -3.704 1.00 0.00 C ATOM 1146 O SER A3308 -13.460 -0.957 -3.091 1.00 0.00 O ATOM 1147 CB SER A3308 -15.287 -1.375 -5.935 1.00 0.00 C ATOM 1148 OG SER A3308 -15.251 -1.163 -7.334 1.00 0.00 O ATOM 0 H SER A3308 -12.865 -1.528 -6.075 1.00 0.00 H new ATOM 0 HA SER A3308 -14.681 0.646 -5.443 1.00 0.00 H new ATOM 0 HB2 SER A3308 -14.975 -2.394 -5.706 1.00 0.00 H new ATOM 0 HB3 SER A3308 -16.308 -1.265 -5.569 1.00 0.00 H new ATOM 0 HG SER A3308 -15.841 -1.808 -7.778 1.00 0.00 H new ATOM 1154 N GLU A3309 -15.593 -0.278 -3.059 1.00 0.00 N ATOM 1155 CA GLU A3309 -15.696 -0.432 -1.612 1.00 0.00 C ATOM 1156 C GLU A3309 -15.526 -1.883 -1.267 1.00 0.00 C ATOM 1157 O GLU A3309 -14.635 -2.190 -0.508 1.00 0.00 O ATOM 1158 CB GLU A3309 -17.060 -0.003 -1.045 1.00 0.00 C ATOM 1159 CG GLU A3309 -17.080 1.447 -0.586 1.00 0.00 C ATOM 1160 CD GLU A3309 -18.095 1.698 0.522 1.00 0.00 C ATOM 1161 OE1 GLU A3309 -17.989 1.095 1.611 1.00 0.00 O ATOM 1162 OE2 GLU A3309 -19.030 2.496 0.289 1.00 0.00 O ATOM 0 H GLU A3309 -16.444 0.051 -3.515 1.00 0.00 H new ATOM 0 HA GLU A3309 -14.925 0.206 -1.180 1.00 0.00 H new ATOM 0 HB2 GLU A3309 -17.826 -0.149 -1.806 1.00 0.00 H new ATOM 0 HB3 GLU A3309 -17.318 -0.648 -0.205 1.00 0.00 H new ATOM 0 HG2 GLU A3309 -16.087 1.726 -0.234 1.00 0.00 H new ATOM 0 HG3 GLU A3309 -17.309 2.090 -1.436 1.00 0.00 H new ATOM 1169 N GLU A3310 -16.247 -2.777 -1.923 1.00 0.00 N ATOM 1170 CA GLU A3310 -16.203 -4.208 -1.659 1.00 0.00 C ATOM 1171 C GLU A3310 -14.766 -4.726 -1.682 1.00 0.00 C ATOM 1172 O GLU A3310 -14.518 -5.825 -1.195 1.00 0.00 O ATOM 1173 CB GLU A3310 -17.092 -4.956 -2.667 1.00 0.00 C ATOM 1174 CG GLU A3310 -18.461 -4.289 -2.883 1.00 0.00 C ATOM 1175 CD GLU A3310 -19.251 -4.069 -1.590 1.00 0.00 C ATOM 1176 OE1 GLU A3310 -19.484 -2.886 -1.245 1.00 0.00 O ATOM 1177 OE2 GLU A3310 -19.639 -5.058 -0.931 1.00 0.00 O ATOM 0 H GLU A3310 -16.894 -2.524 -2.670 1.00 0.00 H new ATOM 0 HA GLU A3310 -16.594 -4.393 -0.658 1.00 0.00 H new ATOM 0 HB2 GLU A3310 -16.572 -5.019 -3.623 1.00 0.00 H new ATOM 0 HB3 GLU A3310 -17.244 -5.978 -2.319 1.00 0.00 H new ATOM 0 HG2 GLU A3310 -18.313 -3.328 -3.376 1.00 0.00 H new ATOM 0 HG3 GLU A3310 -19.053 -4.906 -3.559 1.00 0.00 H new ATOM 1184 N GLU A3311 -13.879 -4.077 -2.444 1.00 0.00 N ATOM 1185 CA GLU A3311 -12.495 -4.462 -2.498 1.00 0.00 C ATOM 1186 C GLU A3311 -11.720 -3.911 -1.298 1.00 0.00 C ATOM 1187 O GLU A3311 -10.972 -4.639 -0.655 1.00 0.00 O ATOM 1188 CB GLU A3311 -11.887 -3.877 -3.764 1.00 0.00 C ATOM 1189 CG GLU A3311 -12.536 -4.347 -5.074 1.00 0.00 C ATOM 1190 CD GLU A3311 -11.711 -5.376 -5.846 1.00 0.00 C ATOM 1191 OE1 GLU A3311 -10.749 -5.975 -5.303 1.00 0.00 O ATOM 1192 OE2 GLU A3311 -12.012 -5.566 -7.043 1.00 0.00 O ATOM 0 H GLU A3311 -14.114 -3.277 -3.031 1.00 0.00 H new ATOM 0 HA GLU A3311 -12.434 -5.550 -2.486 1.00 0.00 H new ATOM 0 HB2 GLU A3311 -11.954 -2.790 -3.712 1.00 0.00 H new ATOM 0 HB3 GLU A3311 -10.827 -4.130 -3.790 1.00 0.00 H new ATOM 0 HG2 GLU A3311 -13.513 -4.775 -4.850 1.00 0.00 H new ATOM 0 HG3 GLU A3311 -12.707 -3.481 -5.713 1.00 0.00 H new ATOM 1199 N LEU A3312 -11.820 -2.598 -1.049 1.00 0.00 N ATOM 1200 CA LEU A3312 -11.123 -1.878 0.025 1.00 0.00 C ATOM 1201 C LEU A3312 -11.718 -2.060 1.414 1.00 0.00 C ATOM 1202 O LEU A3312 -11.030 -2.424 2.366 1.00 0.00 O ATOM 1203 CB LEU A3312 -11.095 -0.364 -0.243 1.00 0.00 C ATOM 1204 CG LEU A3312 -10.769 0.056 -1.680 1.00 0.00 C ATOM 1205 CD1 LEU A3312 -11.535 1.331 -1.999 1.00 0.00 C ATOM 1206 CD2 LEU A3312 -9.263 0.161 -1.898 1.00 0.00 C ATOM 0 H LEU A3312 -12.411 -1.986 -1.611 1.00 0.00 H new ATOM 0 HA LEU A3312 -10.126 -2.319 0.017 1.00 0.00 H new ATOM 0 HB2 LEU A3312 -12.067 0.051 0.024 1.00 0.00 H new ATOM 0 HB3 LEU A3312 -10.361 0.090 0.423 1.00 0.00 H new ATOM 0 HG LEU A3312 -11.096 -0.707 -2.386 1.00 0.00 H new ATOM 0 HD11 LEU A3312 -11.313 1.643 -3.020 1.00 0.00 H new ATOM 0 HD12 LEU A3312 -12.605 1.147 -1.900 1.00 0.00 H new ATOM 0 HD13 LEU A3312 -11.237 2.118 -1.306 1.00 0.00 H new ATOM 0 HD21 LEU A3312 -9.064 0.461 -2.927 1.00 0.00 H new ATOM 0 HD22 LEU A3312 -8.848 0.904 -1.217 1.00 0.00 H new ATOM 0 HD23 LEU A3312 -8.799 -0.807 -1.706 1.00 0.00 H new ATOM 1218 N LEU A3313 -13.015 -1.779 1.515 1.00 0.00 N ATOM 1219 CA LEU A3313 -13.850 -1.861 2.691 1.00 0.00 C ATOM 1220 C LEU A3313 -13.689 -3.270 3.234 1.00 0.00 C ATOM 1221 O LEU A3313 -13.492 -3.425 4.434 1.00 0.00 O ATOM 1222 CB LEU A3313 -15.307 -1.478 2.316 1.00 0.00 C ATOM 1223 CG LEU A3313 -16.382 -1.638 3.414 1.00 0.00 C ATOM 1224 CD1 LEU A3313 -16.851 -3.083 3.640 1.00 0.00 C ATOM 1225 CD2 LEU A3313 -16.028 -1.032 4.770 1.00 0.00 C ATOM 0 H LEU A3313 -13.545 -1.462 0.703 1.00 0.00 H new ATOM 0 HA LEU A3313 -13.564 -1.160 3.475 1.00 0.00 H new ATOM 0 HB2 LEU A3313 -15.310 -0.438 1.989 1.00 0.00 H new ATOM 0 HB3 LEU A3313 -15.606 -2.082 1.460 1.00 0.00 H new ATOM 0 HG LEU A3313 -17.201 -1.059 2.987 1.00 0.00 H new ATOM 0 HD11 LEU A3313 -17.605 -3.102 4.427 1.00 0.00 H new ATOM 0 HD12 LEU A3313 -17.280 -3.475 2.718 1.00 0.00 H new ATOM 0 HD13 LEU A3313 -16.002 -3.699 3.936 1.00 0.00 H new ATOM 0 HD21 LEU A3313 -16.848 -1.199 5.468 1.00 0.00 H new ATOM 0 HD22 LEU A3313 -15.123 -1.503 5.154 1.00 0.00 H new ATOM 0 HD23 LEU A3313 -15.860 0.039 4.657 1.00 0.00 H new ATOM 1237 N ALA A3314 -13.649 -4.282 2.367 1.00 0.00 N ATOM 1238 CA ALA A3314 -13.504 -5.643 2.839 1.00 0.00 C ATOM 1239 C ALA A3314 -12.149 -5.915 3.510 1.00 0.00 C ATOM 1240 O ALA A3314 -12.049 -6.763 4.395 1.00 0.00 O ATOM 1241 CB ALA A3314 -13.714 -6.585 1.656 1.00 0.00 C ATOM 0 H ALA A3314 -13.714 -4.181 1.354 1.00 0.00 H new ATOM 0 HA ALA A3314 -14.254 -5.813 3.612 1.00 0.00 H new ATOM 0 HB1 ALA A3314 -13.609 -7.617 1.990 1.00 0.00 H new ATOM 0 HB2 ALA A3314 -14.713 -6.436 1.245 1.00 0.00 H new ATOM 0 HB3 ALA A3314 -12.970 -6.375 0.887 1.00 0.00 H new ATOM 1247 N MET A3315 -11.095 -5.183 3.133 1.00 0.00 N ATOM 1248 CA MET A3315 -9.739 -5.359 3.669 1.00 0.00 C ATOM 1249 C MET A3315 -9.644 -4.725 5.043 1.00 0.00 C ATOM 1250 O MET A3315 -9.203 -5.349 6.009 1.00 0.00 O ATOM 1251 CB MET A3315 -8.666 -4.740 2.750 1.00 0.00 C ATOM 1252 CG MET A3315 -8.865 -5.095 1.280 1.00 0.00 C ATOM 1253 SD MET A3315 -7.635 -6.172 0.506 1.00 0.00 S ATOM 1254 CE MET A3315 -6.295 -4.987 0.249 1.00 0.00 C ATOM 0 H MET A3315 -11.160 -4.440 2.437 1.00 0.00 H new ATOM 0 HA MET A3315 -9.551 -6.431 3.731 1.00 0.00 H new ATOM 0 HB2 MET A3315 -8.681 -3.656 2.862 1.00 0.00 H new ATOM 0 HB3 MET A3315 -7.681 -5.080 3.070 1.00 0.00 H new ATOM 0 HG2 MET A3315 -9.840 -5.571 1.178 1.00 0.00 H new ATOM 0 HG3 MET A3315 -8.903 -4.166 0.712 1.00 0.00 H new ATOM 0 HE1 MET A3315 -5.451 -5.489 -0.223 1.00 0.00 H new ATOM 0 HE2 MET A3315 -6.643 -4.179 -0.394 1.00 0.00 H new ATOM 0 HE3 MET A3315 -5.982 -4.577 1.209 1.00 0.00 H new ATOM 1264 N LEU A3316 -9.998 -3.441 5.129 1.00 0.00 N ATOM 1265 CA LEU A3316 -9.976 -2.704 6.388 1.00 0.00 C ATOM 1266 C LEU A3316 -10.989 -3.295 7.367 1.00 0.00 C ATOM 1267 O LEU A3316 -10.731 -3.293 8.571 1.00 0.00 O ATOM 1268 CB LEU A3316 -10.214 -1.204 6.174 1.00 0.00 C ATOM 1269 CG LEU A3316 -11.501 -0.874 5.390 1.00 0.00 C ATOM 1270 CD1 LEU A3316 -12.700 -0.588 6.304 1.00 0.00 C ATOM 1271 CD2 LEU A3316 -11.298 0.370 4.526 1.00 0.00 C ATOM 0 H LEU A3316 -10.306 -2.887 4.330 1.00 0.00 H new ATOM 0 HA LEU A3316 -8.981 -2.807 6.820 1.00 0.00 H new ATOM 0 HB2 LEU A3316 -10.258 -0.712 7.146 1.00 0.00 H new ATOM 0 HB3 LEU A3316 -9.360 -0.784 5.642 1.00 0.00 H new ATOM 0 HG LEU A3316 -11.709 -1.757 4.786 1.00 0.00 H new ATOM 0 HD11 LEU A3316 -13.576 -0.362 5.695 1.00 0.00 H new ATOM 0 HD12 LEU A3316 -12.903 -1.463 6.922 1.00 0.00 H new ATOM 0 HD13 LEU A3316 -12.474 0.264 6.945 1.00 0.00 H new ATOM 0 HD21 LEU A3316 -12.216 0.588 3.980 1.00 0.00 H new ATOM 0 HD22 LEU A3316 -11.045 1.218 5.163 1.00 0.00 H new ATOM 0 HD23 LEU A3316 -10.488 0.193 3.818 1.00 0.00 H new ATOM 1283 N ASN A3317 -12.125 -3.805 6.880 1.00 0.00 N ATOM 1284 CA ASN A3317 -13.125 -4.397 7.761 1.00 0.00 C ATOM 1285 C ASN A3317 -12.744 -5.830 8.098 1.00 0.00 C ATOM 1286 O ASN A3317 -13.117 -6.326 9.160 1.00 0.00 O ATOM 1287 CB ASN A3317 -14.546 -4.316 7.180 1.00 0.00 C ATOM 1288 CG ASN A3317 -15.560 -4.129 8.294 1.00 0.00 C ATOM 1289 OD1 ASN A3317 -16.401 -4.979 8.575 1.00 0.00 O ATOM 1290 ND2 ASN A3317 -15.504 -2.984 8.960 1.00 0.00 N ATOM 0 H ASN A3317 -12.369 -3.818 5.890 1.00 0.00 H new ATOM 0 HA ASN A3317 -13.139 -3.812 8.681 1.00 0.00 H new ATOM 0 HB2 ASN A3317 -14.612 -3.486 6.476 1.00 0.00 H new ATOM 0 HB3 ASN A3317 -14.771 -5.225 6.623 1.00 0.00 H new ATOM 0 HD21 ASN A3317 -16.164 -2.801 9.716 1.00 0.00 H new ATOM 0 HD22 ASN A3317 -14.801 -2.286 8.717 1.00 0.00 H new ATOM 1297 N GLY A3318 -11.902 -6.442 7.267 1.00 0.00 N ATOM 1298 CA GLY A3318 -11.437 -7.812 7.430 1.00 0.00 C ATOM 1299 C GLY A3318 -12.650 -8.731 7.462 1.00 0.00 C ATOM 1300 O GLY A3318 -12.847 -9.487 8.421 1.00 0.00 O ATOM 0 H GLY A3318 -11.516 -5.984 6.441 1.00 0.00 H new ATOM 0 HA2 GLY A3318 -10.774 -8.088 6.610 1.00 0.00 H new ATOM 0 HA3 GLY A3318 -10.862 -7.910 8.351 1.00 0.00 H new ATOM 1304 N ASP A3319 -13.511 -8.575 6.460 1.00 0.00 N ATOM 1305 CA ASP A3319 -14.748 -9.323 6.292 1.00 0.00 C ATOM 1306 C ASP A3319 -14.537 -10.596 5.468 1.00 0.00 C ATOM 1307 O ASP A3319 -13.403 -11.027 5.244 1.00 0.00 O ATOM 1308 CB ASP A3319 -15.862 -8.402 5.772 1.00 0.00 C ATOM 1309 CG ASP A3319 -15.767 -7.983 4.307 1.00 0.00 C ATOM 1310 OD1 ASP A3319 -15.268 -8.774 3.476 1.00 0.00 O ATOM 1311 OD2 ASP A3319 -16.308 -6.894 4.027 1.00 0.00 O ATOM 0 H ASP A3319 -13.357 -7.896 5.714 1.00 0.00 H new ATOM 0 HA ASP A3319 -15.083 -9.683 7.264 1.00 0.00 H new ATOM 0 HB2 ASP A3319 -16.818 -8.903 5.923 1.00 0.00 H new ATOM 0 HB3 ASP A3319 -15.874 -7.501 6.385 1.00 0.00 H new ATOM 1316 N GLN A3320 -15.639 -11.219 5.053 1.00 0.00 N ATOM 1317 CA GLN A3320 -15.719 -12.452 4.286 1.00 0.00 C ATOM 1318 C GLN A3320 -16.596 -12.329 3.043 1.00 0.00 C ATOM 1319 O GLN A3320 -17.205 -13.315 2.631 1.00 0.00 O ATOM 1320 CB GLN A3320 -16.182 -13.580 5.230 1.00 0.00 C ATOM 1321 CG GLN A3320 -17.532 -13.316 5.935 1.00 0.00 C ATOM 1322 CD GLN A3320 -17.448 -12.239 7.012 1.00 0.00 C ATOM 1323 OE1 GLN A3320 -18.030 -11.167 6.875 1.00 0.00 O ATOM 1324 NE2 GLN A3320 -16.684 -12.468 8.068 1.00 0.00 N ATOM 0 H GLN A3320 -16.564 -10.844 5.262 1.00 0.00 H new ATOM 0 HA GLN A3320 -14.730 -12.690 3.894 1.00 0.00 H new ATOM 0 HB2 GLN A3320 -16.260 -14.505 4.658 1.00 0.00 H new ATOM 0 HB3 GLN A3320 -15.416 -13.738 5.989 1.00 0.00 H new ATOM 0 HG2 GLN A3320 -18.271 -13.019 5.191 1.00 0.00 H new ATOM 0 HG3 GLN A3320 -17.887 -14.243 6.385 1.00 0.00 H new ATOM 0 HE21 GLN A3320 -16.207 -13.364 8.168 1.00 0.00 H new ATOM 0 HE22 GLN A3320 -16.572 -11.749 8.782 1.00 0.00 H new ATOM 1333 N GLN A3321 -16.752 -11.115 2.527 1.00 0.00 N ATOM 1334 CA GLN A3321 -17.553 -10.861 1.341 1.00 0.00 C ATOM 1335 C GLN A3321 -16.691 -11.150 0.130 1.00 0.00 C ATOM 1336 O GLN A3321 -15.597 -10.552 0.010 1.00 0.00 O ATOM 1337 CB GLN A3321 -18.105 -9.432 1.365 1.00 0.00 C ATOM 1338 CG GLN A3321 -19.328 -9.339 2.296 1.00 0.00 C ATOM 1339 CD GLN A3321 -19.392 -7.978 2.974 1.00 0.00 C ATOM 1340 OE1 GLN A3321 -19.920 -7.014 2.438 1.00 0.00 O ATOM 1341 NE2 GLN A3321 -18.838 -7.879 4.170 1.00 0.00 N ATOM 0 H GLN A3321 -16.324 -10.278 2.923 1.00 0.00 H new ATOM 0 HA GLN A3321 -18.426 -11.512 1.304 1.00 0.00 H new ATOM 0 HB2 GLN A3321 -17.331 -8.743 1.703 1.00 0.00 H new ATOM 0 HB3 GLN A3321 -18.385 -9.127 0.357 1.00 0.00 H new ATOM 0 HG2 GLN A3321 -20.240 -9.508 1.723 1.00 0.00 H new ATOM 0 HG3 GLN A3321 -19.276 -10.124 3.051 1.00 0.00 H new ATOM 0 HE21 GLN A3321 -18.403 -8.695 4.600 1.00 0.00 H new ATOM 0 HE22 GLN A3321 -18.846 -6.986 4.663 1.00 0.00 H new TER 1350 GLN A3321